data_1g9l_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1g9l _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.654 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.838 0.351 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.625 ' HA ' HD23 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -173.98 -163.76 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.514 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.563 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -58.29 -43.8 88.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.506 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.77 ' HB2' ' HE3' ' A' ' 57' ' ' MET . 31.9 m -56.56 -45.39 81.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.844 0.354 . . . . 0.0 110.487 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.77 ' HE3' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -61.43 -40.43 94.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.861 ' HG ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -60.98 -45.38 95.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -9.1 52.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.08 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.0 t -82.41 -8.73 59.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB3' ' HE1' ' A' ' 69' ' ' MET . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.169 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.519 ' O ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.053 0.454 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.649 ' HA ' HD21 ' A' ' 70' ' ' LEU . 4.7 mmtt -124.79 35.17 4.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.577 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -130.42 -61.97 0.94 Allowed 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.51 ' O ' HD11 ' A' ' 53' ' ' LEU . 35.9 mtm -58.82 -9.38 1.76 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.861 HD23 ' HG ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -70.12 -28.31 65.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.961 0.41 . . . . 0.0 110.81 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.882 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -146.52 9.92 1.45 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.442 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.28 -9.62 6.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.516 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.16 -12.73 5.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.909 0.385 . . . . 0.0 110.531 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.63 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.59 -17.1 58.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.928 -179.313 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.693 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.7 t80 -47.12 -54.57 19.93 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 22.1 Cg_exo -65.37 -9.25 21.48 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.134 1.889 . . . . 0.0 112.249 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.654 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.3 mm? -96.3 -39.06 9.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.794 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.601 HG23 HD13 ' A' ' 89' ' ' ILE . 4.0 mm -60.34 -41.61 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.859 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.647 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.4 mt-30 -48.53 -20.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.627 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.72 -43.67 16.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.856 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.606 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -67.78 -40.85 83.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.5 179.604 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.65 ' ND1' HD12 ' A' ' 89' ' ' ILE . 4.9 m170 -123.18 144.1 42.65 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.55 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.459 ' O ' HD11 ' A' ' 85' ' ' LEU . 41.2 Cg_exo -55.75 81.57 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.478 2.119 . . . . 0.0 111.715 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.647 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 9.4 t 41.42 30.3 0.13 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.276 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.459 HD11 ' O ' ' A' ' 83' ' ' PRO . 1.2 mp -80.56 0.4 34.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.075 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.54 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -66.67 -138.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.621 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.88 -8.56 49.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.856 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.564 ' HE2' ' SD ' ' A' ' 92' ' ' MET . 1.2 tptt -161.3 -25.6 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.738 -0.231 . . . . 0.0 111.501 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.784 HG22 HG21 ' A' ' 119' ' ' VAL . 61.0 mt -49.2 -80.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.882 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.63 -38.51 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.684 -0.235 . . . . 0.0 110.937 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.79 -28.7 57.55 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.661 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.1 ttp -77.39 -34.34 54.9 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.199 0.523 . . . . 0.0 109.827 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.678 ' HG ' HG22 ' A' ' 115' ' ' VAL . 4.5 mm? -58.76 -7.97 1.17 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.691 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.636 HD11 ' HA3' ' A' ' 71' ' ' GLY . 4.4 mp -107.84 27.83 8.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -171.59 3.24 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.521 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.946 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.332 0.587 . . . . 0.0 111.85 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.42 -2.46 0.32 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.361 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 9.6 m-20 78.27 -30.12 0.16 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.42 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.412 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.5 m -72.87 -31.88 65.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.074 0.464 . . . . 0.0 109.83 178.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.946 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.9 OUTLIER -76.37 -23.3 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.775 177.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -75.27 -23.75 57.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.049 177.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.07 -45.67 8.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.3 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -39.6 92.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.056 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.695 ' HE1' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -59.98 -33.13 71.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.491 -179.56 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.747 HD23 HD13 ' A' ' 70' ' ' LEU . 17.3 mt -85.37 -12.35 52.37 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.742 0.306 . . . . 0.0 110.946 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -8.62 17.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.76 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -142.89 132.54 11.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.87 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 13.8 Cg_exo -69.88 1.62 4.35 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.893 2.395 . . . . 0.0 111.913 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -120.37 -26.56 5.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.272 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.76 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.93 -45.24 90.13 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.695 ' HG ' ' HE1' ' A' ' 104' ' ' MET . 4.7 tt -57.19 -26.28 60.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.062 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.606 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 1.9 ttt180 -88.28 -46.58 9.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.256 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 t -69.3 -33.53 73.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.874 0.369 . . . . 0.0 110.713 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.662 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 6.8 mmtt -78.85 -27.81 44.2 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.185 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.678 HG22 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -72.39 -55.88 11.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.298 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.648 ' HA ' HG23 ' A' ' 119' ' ' VAL . 20.2 t0 -52.91 -39.01 62.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 177.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -39.66 75.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.423 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.81 -22.07 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.043 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.784 HG21 HG22 ' A' ' 89' ' ' ILE . 56.1 t -65.3 -44.77 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.938 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.14 -25.93 65.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.505 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 121' ' ' VAL . 10.2 t -86.92 -31.39 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.857 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.59 HD23 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -71.98 -40.53 68.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.992 179.178 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.403 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 81.1 mm-40 -68.48 -32.01 71.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.159 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.923 179.065 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.704 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.752 0.31 . . . . 0.0 110.67 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.517 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.58 -167.44 0.78 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.433 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.538 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -52.57 -43.97 65.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.852 -178.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.419 ' HB2' ' HE3' ' A' ' 57' ' ' MET . 0.8 OUTLIER -57.72 -51.23 70.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.874 0.369 . . . . 0.0 110.747 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.495 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.19 -38.59 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.248 179.166 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.528 HD23 HD21 ' A' ' 70' ' ' LEU . 16.0 mt -63.96 -42.89 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.064 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.18 -15.59 60.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.058 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 57' ' ' MET . 69.6 m -73.86 -6.98 50.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.884 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.039 -179.966 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.401 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.918 0.39 . . . . 0.0 110.825 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.551 ' CA ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -129.75 28.65 5.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.841 179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.442 ' HG3' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -132.37 -54.98 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.965 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.452 ' SD ' HD23 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -75.52 18.1 0.25 Allowed 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -177.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.776 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.42 -32.58 17.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.239 0.542 . . . . 0.0 110.445 179.619 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.899 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -134.15 11.6 4.74 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.037 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.442 ' HG2' ' HG3' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -129.26 -8.54 4.75 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.145 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.554 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -127.34 -14.17 5.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.774 0.321 . . . . 0.0 110.969 179.852 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.617 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -77.31 -10.99 59.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.7 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 11.5 t80 -49.01 -55.41 20.78 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.68 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.7 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.6 Cg_exo -62.34 -9.73 16.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.087 1.858 . . . . 0.0 112.157 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.704 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.5 mm? -98.81 -28.21 13.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.579 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.743 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.8 mm -70.6 -40.47 77.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.732 0.301 . . . . 0.0 111.244 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.75 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.7 mt-30 -52.62 -19.3 2.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.351 0.596 . . . . 0.0 110.103 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.26 -38.88 30.04 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.959 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.743 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.2 -48.63 33.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.24 0.543 . . . . 0.0 110.167 179.413 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.5 m-70 -111.97 146.18 34.26 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.467 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.624 ' HD2' HD12 ' A' ' 85' ' ' LEU . 36.6 Cg_exo -57.18 78.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.544 2.163 . . . . 0.0 112.014 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.75 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 48.17 37.17 7.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.062 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.3 OUTLIER -92.48 4.99 52.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -179.351 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.695 ' HB3' ' HB ' ' A' ' 78' ' ' ILE . . . -69.88 -138.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.948 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.85 -10.14 53.38 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.793 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.629 ' HB3' HD11 ' A' ' 122' ' ' LEU . 1.1 tptt -159.96 -23.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.694 -0.253 . . . . 0.0 111.536 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.687 HG21 HG23 ' A' ' 119' ' ' VAL . 69.2 mt -49.68 -81.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.899 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -55.95 -37.72 69.39 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.636 0.255 . . . . 0.0 110.672 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.42 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.63 -28.45 59.93 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.218 -0.991 . . . . 0.0 110.648 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.612 ' O ' HG22 ' A' ' 96' ' ' ILE . 2.8 ttp -76.91 -33.99 57.74 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.352 0.596 . . . . 0.0 109.718 177.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.717 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.5 mm? -60.23 -4.61 0.85 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.829 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.61 HD11 ' HA3' ' A' ' 71' ' ' GLY . 3.4 mp -110.04 25.88 11.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 176.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -168.04 1.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.358 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.21 -153.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.439 0.638 . . . . 0.0 111.955 -179.531 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.403 ' H ' ' HB ' ' A' ' 96' ' ' ILE . 12.6 t0 -59.82 -2.62 0.41 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.302 178.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.582 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.49 -36.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.163 -179.466 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 3.0 m -65.28 -27.35 68.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.847 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.904 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -82.99 -25.62 32.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.587 177.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.673 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 2.3 tp -75.14 -25.33 58.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.701 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.75 -48.02 7.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.323 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.447 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -65.27 -37.01 85.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.429 -178.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.673 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 8.2 ptm -60.09 -38.17 82.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.797 0.332 . . . . 0.0 111.083 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.776 HD21 HD13 ' A' ' 70' ' ' LEU . 40.2 mt -81.64 -11.43 59.1 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.953 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.48 -9.11 14.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.857 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.825 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -140.77 126.95 11.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.661 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 17.1 Cg_exo -68.07 6.72 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.876 2.384 . . . . 0.0 112.314 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.43 ' H ' ' C ' ' A' ' 107' ' ' SER . 2.1 tt0 -127.8 -26.43 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.825 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.1 -46.78 85.72 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.642 HD13 ' HE3' ' A' ' 104' ' ' MET . 4.7 tt -49.99 -23.71 2.18 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.779 178.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 112' ' ' ARG . 15.1 mtp180 -92.96 -62.96 1.28 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.2 t -50.05 -29.54 9.03 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.126 0.489 . . . . 0.0 109.791 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.649 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -81.0 -42.98 20.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.666 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.717 HG23 ' HG ' ' A' ' 93' ' ' LEU . 1.2 t -63.97 -58.15 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.636 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.8 OUTLIER -50.98 -42.72 60.36 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.734 0.302 . . . . 0.0 110.868 178.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 113' ' ' SER . 4.4 mt-10 -70.31 -32.46 70.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.327 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 114' ' ' LYS . . . -69.01 -24.74 64.25 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.113 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.744 ' HA ' HD21 ' A' ' 122' ' ' LEU . 21.8 t -63.38 -46.11 96.27 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 CA-C-O 121.291 0.567 . . . . 0.0 109.664 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.44 -26.27 63.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.742 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 121' ' ' VAL . 7.9 t -86.98 -32.63 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.741 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.744 HD21 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -69.61 -38.29 77.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.93 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.435 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 14.6 mm100 -74.16 -27.0 60.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.962 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.268 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.073 178.876 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.701 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.613 0.244 . . . . 0.0 110.535 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.583 ' HA ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -170.21 -159.37 0.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.751 179.501 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -60.69 -37.31 81.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.313 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.607 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 6.3 m -59.8 -46.46 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.349 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.666 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.92 -40.65 94.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.191 178.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.489 ' CD2' ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.31 -47.19 84.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.561 179.214 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.94 -12.68 61.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.217 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.429 ' HB3' ' O ' ' A' ' 57' ' ' MET . 46.3 t -76.39 -7.36 54.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.185 179.936 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 120.739 0.304 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.446 ' O ' HD12 ' A' ' 70' ' ' LEU . 2.8 mtpt -124.83 18.16 8.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.358 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.75 -43.57 3.13 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.396 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 30.4 mtm -77.22 -9.63 58.91 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.67 HD22 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -58.49 -39.61 80.49 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.874 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -144.65 28.71 1.89 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.817 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -138.47 -9.32 1.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.583 0.23 . . . . 0.0 111.308 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.408 ' HD3' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -127.06 -14.84 5.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.783 0.325 . . . . 0.0 111.007 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.651 HD12 HD23 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.01 -25.19 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.855 -179.614 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.48 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.0 t80 -42.75 -55.69 6.94 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.169 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 19.3 Cg_endo -59.7 -18.23 46.97 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.976 1.784 . . . . 0.0 112.386 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.701 HD13 ' HB2' ' A' ' 53' ' ' LEU . 84.8 mt -99.09 -22.15 15.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.991 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.623 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.9 mm -65.46 -37.87 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.895 0.379 . . . . 0.0 110.431 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.476 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.4 mt-30 -53.93 -18.11 3.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.78 -34.57 30.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.08 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.472 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -79.35 -40.78 29.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.067 -178.326 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.677 ' ND1' HG12 ' A' ' 119' ' ' VAL . 1.4 m-70 -118.12 159.68 42.17 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.234 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.71 75.17 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.31 2.007 . . . . 0.0 111.796 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.476 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 43.8 p 45.73 36.09 2.54 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.982 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -87.23 1.84 51.92 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.045 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.567 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -65.72 -143.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.095 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.31 -11.66 60.39 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.301 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.896 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.1 ttpt -160.47 -21.96 0.06 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.697 HG23 HG11 ' A' ' 115' ' ' VAL . 64.0 mt -49.03 -80.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.874 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.6 -39.22 67.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.575 0.226 . . . . 0.0 110.768 -179.37 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.66 -27.54 64.04 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.896 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.8 ttm -76.46 -36.42 57.92 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.516 0.674 . . . . 0.0 109.561 177.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.749 ' HG ' HG22 ' A' ' 115' ' ' VAL . 4.4 mm? -57.71 -6.83 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.432 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.65 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.14 27.39 9.33 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.6 pt-20 -170.84 2.57 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.091 -0.958 . . . . 0.0 111.357 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.34 -150.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.456 0.646 . . . . 0.0 111.77 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.567 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 8.1 t0 -59.09 -3.97 0.44 Allowed 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.043 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.567 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 8.5 m120 78.79 -26.48 0.17 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.483 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.39 -32.12 60.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.103 0.477 . . . . 0.0 109.865 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.2 mt-10 -74.79 -24.85 58.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.837 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.633 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.7 tp -75.02 -24.66 58.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.958 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.9 mp -90.47 -47.03 7.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.122 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -37.12 85.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.352 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.633 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 6.0 ptm -60.07 -39.07 84.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.742 0.306 . . . . 0.0 110.793 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.67 HD21 HD22 ' A' ' 70' ' ' LEU . 59.8 mt -78.33 -13.13 59.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.541 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -109.41 -5.13 15.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.037 -177.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.815 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.7 t -147.31 139.69 14.21 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.228 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.491 ' HA ' ' HB ' ' A' ' 54' ' ' THR . 85.8 Cg_endo -80.05 2.92 8.05 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.981 2.454 . . . . 0.0 112.009 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -122.87 -18.96 6.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.306 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.815 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -72.24 -50.62 25.96 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.651 HD23 HD12 ' A' ' 74' ' ' LEU . 6.1 tt -50.09 -34.19 21.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.112 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -85.69 -60.04 2.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.228 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.5 m -53.63 -35.86 61.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.866 0.365 . . . . 0.0 111.027 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.63 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.2 mmtt -78.73 -28.59 44.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.557 179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.749 HG22 ' HG ' ' A' ' 93' ' ' LEU . 1.0 OUTLIER -71.07 -50.63 40.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.388 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.595 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -59.3 -38.82 81.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.432 177.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.1 -33.32 67.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.595 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.495 ' HB2' ' HE2' ' A' ' 92' ' ' MET . . . -65.43 -30.11 70.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.656 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.694 HG21 HD11 ' A' ' 89' ' ' ILE . 21.8 t -56.61 -53.38 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.699 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.33 -25.68 16.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.348 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 121' ' ' VAL . 5.1 t -86.81 -32.55 6.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.422 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.827 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.28 -39.36 74.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.086 179.077 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.475 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -73.13 -26.91 61.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.659 178.049 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.504 179.491 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.757 ' H ' HD21 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.727 0.299 . . . . 0.0 110.823 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.851 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.14 -176.18 1.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.042 178.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.575 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -49.48 -43.7 45.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.839 -179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.875 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 50.4 m -60.36 -48.14 83.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.026 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.875 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.22 -42.06 85.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.294 0.569 . . . . 0.0 110.472 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.641 HD12 HD21 ' A' ' 105' ' ' LEU . 9.5 mt -62.38 -45.17 94.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.19 -15.22 44.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.966 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 t -76.08 -6.32 50.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.104 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.428 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.934 0.397 . . . . 0.0 110.609 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.527 ' CA ' HD21 ' A' ' 70' ' ' LEU . 9.4 pttt -131.43 26.89 4.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.895 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -131.02 -56.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.508 ' SD ' HD12 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -77.98 18.35 0.5 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.527 HD21 ' CA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.1 -32.76 17.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.31 0.576 . . . . 0.0 110.138 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.861 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -131.33 12.6 5.48 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.739 178.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -128.66 -3.42 5.34 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.491 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.99 -19.79 4.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.83 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.637 ' HB3' HD13 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -77.29 -22.17 52.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.107 -178.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.642 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.8 t80 -44.55 -55.17 10.78 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.102 -177.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 31.5 Cg_exo -60.4 -15.71 37.28 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.166 1.911 . . . . 0.0 112.711 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.757 HD21 ' H ' ' A' ' 53' ' ' LEU . 0.1 OUTLIER -98.65 -28.41 13.55 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.341 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.637 HD13 ' HB3' ' A' ' 74' ' ' LEU . 6.8 mm -61.66 -40.52 86.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.577 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.84 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 19.0 mt-30 -52.31 -17.43 1.15 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.914 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.22 -35.65 23.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.079 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -75.9 -37.62 58.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.925 -179.345 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.752 ' ND1' HG12 ' A' ' 119' ' ' VAL . 1.8 m-70 -121.22 162.64 34.62 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.502 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.408 ' HD2' HD11 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.46 71.67 0.64 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.298 1.998 . . . . 0.0 111.86 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.84 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.4 p 49.11 32.35 4.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.119 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.462 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 27.4 mt -84.71 5.91 26.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.22 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.602 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -67.53 -141.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.898 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.31 -10.67 34.49 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.456 -0.878 . . . . 0.0 111.608 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.817 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.1 OUTLIER -156.3 -25.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 179.791 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.645 HG23 HG12 ' A' ' 115' ' ' VAL . 56.6 mt -49.26 -85.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-O 120.629 0.252 . . . . 0.0 111.558 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.861 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.98 -40.0 66.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.0 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.59 -30.02 58.55 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.168 -1.015 . . . . 0.0 111.029 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.817 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.77 -25.62 32.61 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.624 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.3 mm? -60.77 -8.08 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.677 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.581 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.9 mm? -105.79 25.84 10.35 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 3.9 pt-20 -167.3 1.58 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.547 -178.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.886 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.0 -152.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.448 0.642 . . . . 0.0 111.963 -179.137 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.5 t70 -59.08 -2.95 0.3 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.272 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.559 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 12.7 m-80 78.14 -28.78 0.16 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.28 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.42 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.5 m -72.59 -31.03 64.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.132 0.491 . . . . 0.0 109.839 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.886 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.8 OUTLIER -78.17 -22.29 48.9 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.633 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.649 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.4 tp -75.14 -24.74 58.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.782 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.6 mp -91.15 -47.3 7.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.221 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -37.18 86.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.59 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.932 ' HE3' HD21 ' A' ' 111' ' ' LEU . 8.3 ptm -59.53 -38.74 81.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.572 0.225 . . . . 0.0 111.033 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.641 HD21 HD12 ' A' ' 58' ' ' LEU . 4.0 mt -86.62 -7.71 58.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.11 0.481 . . . . 0.0 110.093 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -108.99 -5.8 15.92 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.771 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.707 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.3 t -146.05 130.95 8.98 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 111.447 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 8.6 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.552 2.168 . . . . 0.0 112.076 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.418 ' H ' ' C ' ' A' ' 107' ' ' SER . 1.7 tt0 -128.67 -27.51 2.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.308 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.707 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -63.95 -44.57 92.4 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.054 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.932 HD21 ' HE3' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.15 -42.23 13.63 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 175.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.618 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 2.3 ttt180 -79.68 -64.91 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.522 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 33.3 t -48.65 -52.63 22.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.788 0.328 . . . . 0.0 111.328 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.619 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 10.5 mmtm -60.21 -30.96 69.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.05 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.645 HG12 HG23 ' A' ' 89' ' ' ILE . 1.2 t -71.19 -53.76 20.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.55 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -53.47 -36.91 62.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.031 0.443 . . . . 0.0 110.491 177.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.81 -33.96 60.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.985 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 114' ' ' LYS . . . -67.12 -24.37 65.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.043 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.752 HG12 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -65.49 -49.2 79.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.68 176.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.83 -27.49 60.2 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.6 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 121' ' ' VAL . 6.5 t -84.43 -30.28 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.691 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.16 -37.99 61.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.157 179.122 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -75.28 -20.25 59.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.028 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.636 -179.744 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.827 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.935 0.398 . . . . 0.0 111.269 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.628 HG21 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.46 -158.82 0.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.279 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.541 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -60.62 -40.64 92.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.447 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.3 m -58.27 -46.15 86.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.398 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.827 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.45 -43.33 93.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.12 178.558 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.541 ' CD2' ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.93 -48.74 75.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.487 178.992 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.29 -9.69 49.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.665 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.7 m -84.73 -8.38 58.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.217 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.553 -179.814 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.94 29.21 4.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.216 -179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.472 ' N ' HD13 ' A' ' 70' ' ' LEU . 4.0 mt-30 -127.37 -48.1 1.44 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.525 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -81.03 13.76 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.179 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.687 HD11 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -81.55 -40.35 23.24 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 120.906 0.384 . . . . 0.0 110.121 179.328 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.964 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -129.8 36.13 2.41 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.84 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 1.4 pt-20 -150.85 -11.85 0.23 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.436 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.92 -15.29 5.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 110.687 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.633 ' HA ' HD21 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.92 -12.43 59.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.31 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.466 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 9.1 t80 -48.19 -54.91 21.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.818 -177.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.48 ' HG2' HD22 ' A' ' 77' ' ' LEU . 36.7 Cg_endo -65.03 -8.08 17.2 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.114 1.876 . . . . 0.0 112.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.633 HD21 ' HA ' ' A' ' 74' ' ' LEU . 1.6 mm? -98.54 -28.19 13.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.267 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.77 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.7 mm -69.13 -40.38 80.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.322 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.916 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.9 mt-30 -51.19 -18.3 0.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.281 0.562 . . . . 0.0 110.355 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.35 -39.98 22.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.211 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.77 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.74 -44.35 61.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.091 0.472 . . . . 0.0 110.742 -179.596 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.724 ' ND1' HG12 ' A' ' 119' ' ' VAL . 1.7 m-70 -115.51 155.76 46.84 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.642 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.436 ' HD2' HD11 ' A' ' 85' ' ' LEU . 24.4 Cg_exo -62.92 76.18 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.508 2.139 . . . . 0.0 111.736 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.916 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.5 p 46.84 33.7 2.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.133 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 17.9 mt -87.18 6.41 33.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.211 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.619 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -69.6 -137.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.961 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.486 ' H ' ' HB3' ' A' ' 86' ' ' ALA . . . 82.1 -15.86 25.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.769 -178.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.89 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.0 ttpt -156.62 -21.6 0.1 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.688 HG22 HG13 ' A' ' 115' ' ' VAL . 62.0 mt -49.54 -81.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.964 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.26 -39.3 66.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.455 0.169 . . . . 0.0 110.795 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.07 -28.03 63.3 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.093 -1.051 . . . . 0.0 110.573 176.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.89 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.7 ttm -76.32 -36.87 58.07 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.521 0.677 . . . . 0.0 109.793 177.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.633 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.5 mm? -56.98 -6.32 0.34 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.561 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.632 HD22 ' HA3' ' A' ' 71' ' ' GLY . 2.3 mm? -108.75 27.7 9.17 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -170.1 1.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.195 -178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.924 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.16 -153.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 121.4 0.619 . . . . 0.0 111.616 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 99' ' ' SER . 7.6 t0 -59.34 -3.14 0.37 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.139 178.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.567 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.9 -35.14 0.17 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.264 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.415 ' H ' ' C ' ' A' ' 97' ' ' ASP . 2.1 m -67.32 -25.77 66.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.833 178.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.924 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.56 -24.67 31.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.858 177.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.49 HD22 ' O ' ' A' ' 93' ' ' LEU . 2.3 tm? -74.95 -27.19 60.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.54 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.7 mp -86.69 -46.83 9.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.36 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -37.93 85.06 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.201 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.697 ' HE3' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.86 -36.09 74.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.157 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.634 HD21 ' HG ' ' A' ' 70' ' ' LEU . 16.3 mt -86.92 -9.92 54.53 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.136 0.493 . . . . 0.0 110.1 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -107.5 -6.44 17.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.258 -176.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.825 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -148.71 130.33 7.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.636 0.255 . . . . 0.0 111.518 -179.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.57 -0.53 6.08 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.926 2.417 . . . . 0.0 112.465 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -123.69 -13.66 7.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.535 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.825 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -71.94 -46.04 58.96 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.016 0.436 . . . . 0.0 110.202 178.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.697 ' HG ' ' HE3' ' A' ' 104' ' ' MET . 6.4 tt -56.17 -29.23 60.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.12 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -88.2 -51.64 5.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.266 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 m -64.02 -35.1 79.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.958 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.561 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 27.0 mmtt -78.98 -29.5 43.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.58 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.688 HG13 HG22 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.81 -51.44 40.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.158 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.505 ' N ' HG11 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.65 -37.76 73.9 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.378 178.695 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -37.58 70.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -62.87 -26.97 69.03 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.962 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.724 HG12 ' ND1' ' A' ' 82' ' ' HIS . 20.5 t -62.13 -47.69 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.305 0.574 . . . . 0.0 109.807 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -58.73 -24.27 61.25 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.857 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.405 ' O ' HG13 ' A' ' 121' ' ' VAL . 8.9 t -87.15 -35.42 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.421 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.772 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -66.31 -38.68 88.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -71.99 -29.11 63.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.406 176.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 120' ' ' ALA . . . . . . . . 0 CA--C 1.519 -0.232 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.558 179.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.685 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.659 0.266 . . . . 0.0 110.893 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.496 ' O ' HD21 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.79 -161.86 0.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.666 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -59.59 -36.92 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.382 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.537 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 2.0 m -60.73 -45.7 93.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.405 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.669 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.81 -40.96 94.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.262 0.553 . . . . 0.0 110.113 178.371 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.548 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.04 -47.88 81.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.721 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -8.88 50.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 t -81.75 -9.51 59.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.007 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.163 179.791 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.105 0 CA-C-O 120.932 0.396 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.615 ' HA ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -128.49 34.85 4.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -133.29 -53.86 0.9 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.876 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.499 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.2 ptt? -80.63 22.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.843 HD12 HD21 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -89.16 -40.9 12.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.118 0.485 . . . . 0.0 110.196 179.384 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.936 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -125.64 13.79 7.27 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -130.1 -2.4 4.56 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 20.4 tpp180 -127.11 -22.9 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.081 0.467 . . . . 0.0 111.107 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.652 ' HB3' HD13 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.99 -17.82 60.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.008 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.488 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 11.2 t80 -46.02 -54.88 14.95 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 27.6 Cg_endo -62.17 -15.27 43.15 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.121 1.88 . . . . 0.0 112.506 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 53' ' ' LEU . 54.2 mt -98.74 -23.38 15.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.898 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.652 HD13 ' HB3' ' A' ' 74' ' ' LEU . 10.2 mm -66.37 -41.28 88.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.371 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.854 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.6 mt-30 -53.25 -18.37 2.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.58 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.56 -36.09 29.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.84 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.511 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -74.84 -51.29 14.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.68 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.689 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.2 m-70 -105.16 160.85 24.6 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.237 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HG2' HD12 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.4 71.72 0.62 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.287 1.991 . . . . 0.0 111.949 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.854 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 50.84 38.98 21.25 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.857 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 25.2 mt -95.42 9.87 38.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.313 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.594 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.35 -141.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.733 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.45 -25.03 7.53 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.654 -178.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.691 ' O ' ' HB3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -156.38 12.28 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.46 0.171 . . . . 0.0 111.362 178.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.666 HG22 HG13 ' A' ' 115' ' ' VAL . 88.0 mt -76.19 -89.23 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 119.811 -0.755 . . . . 0.0 110.202 178.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.936 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.38 -40.64 59.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.075 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.507 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.66 -32.4 54.04 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.31 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.691 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.92 -23.12 31.32 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.815 0.341 . . . . 0.0 110.199 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.702 ' HG ' HG22 ' A' ' 115' ' ' VAL . 4.4 mm? -61.39 -6.66 2.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.389 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.585 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.7 mm? -105.14 24.25 12.33 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 176.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.3 pt-20 -166.86 1.73 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.704 -178.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.898 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.98 -151.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.376 0.608 . . . . 0.0 111.826 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.9 t0 -59.23 -3.44 0.4 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.143 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.58 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.3 m-20 78.08 -28.61 0.16 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.509 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.2 m -74.72 -25.15 58.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.898 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.5 OUTLIER -82.64 -26.15 32.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.596 177.251 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.482 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 2.7 tp -75.06 -25.91 59.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.467 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.1 -47.64 9.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.065 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -37.87 82.76 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.3 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.67 ' HE1' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.22 -35.97 72.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.268 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.843 HD21 HD12 ' A' ' 70' ' ' LEU . 11.5 mt -87.05 -12.85 46.08 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.259 0.552 . . . . 0.0 110.068 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -102.49 -8.01 21.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.19 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.817 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -147.32 134.5 10.22 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.677 0.275 . . . . 0.0 111.722 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.18 2.19 5.22 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.69 2.26 . . . . 0.0 112.24 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 113' ' ' SER . 5.7 mt-10 -126.71 -13.7 5.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.576 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.817 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -73.11 -45.13 58.79 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.045 0.45 . . . . 0.0 110.051 177.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.67 ' HG ' ' HE1' ' A' ' 104' ' ' MET . 7.0 tt -56.88 -30.74 64.17 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.119 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.511 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 0.0 OUTLIER -89.76 -44.75 9.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.301 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -68.03 -35.66 78.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.699 -179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 118' ' ' ALA . 23.7 mmtt -78.79 -29.42 44.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.49 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.702 HG22 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -70.56 -52.19 31.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.634 ' HA ' HG22 ' A' ' 119' ' ' VAL . 7.0 t70 -59.0 -34.88 72.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.394 177.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -29.26 48.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.868 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.607 ' HB3' ' SD ' ' A' ' 92' ' ' MET . . . -69.99 -25.31 63.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.781 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.689 HG11 ' ND1' ' A' ' 82' ' ' HIS . 13.1 t -64.96 -51.49 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.877 177.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.35 -24.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.531 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 121' ' ' VAL . 18.5 t -86.69 -31.96 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.82 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.68 -37.1 62.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -77.62 -22.72 50.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.098 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.318 179.635 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.705 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.97 0.414 . . . . 0.0 110.907 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.557 ' HA ' HD21 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.12 -169.57 1.5 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.969 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.566 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -56.84 -31.96 65.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -50.64 61.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.676 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.582 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -57.75 -36.38 72.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.915 178.716 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.582 HD13 HD23 ' A' ' 105' ' ' LEU . 13.0 mt -68.22 -41.57 81.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.417 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.71 -12.69 17.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.913 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 m -75.29 -13.56 60.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.62 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.54 ' O ' ' HB2' ' A' ' 66' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.107 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.54 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.466 ' C ' HD11 ' A' ' 70' ' ' LEU . 2.7 pttm -90.16 29.74 1.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.448 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -124.71 -46.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.967 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 73' ' ' ARG . 43.7 mtm -74.49 -8.98 58.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.696 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.718 HD23 HD22 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -57.94 -52.53 65.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.66 0.267 . . . . 0.0 111.343 -177.807 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.768 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -123.6 23.54 6.68 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.329 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 2.2 mt-10 -136.73 2.31 2.64 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.466 0.174 . . . . 0.0 111.461 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.617 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -125.67 -34.52 2.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.791 ' HB2' HG22 ' A' ' 90' ' ' THR . 2.3 mm? -59.5 -38.48 81.01 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.766 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -26.88 -61.54 0.18 Allowed Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -175.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.766 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 15.9 Cg_exo -69.18 -30.38 25.05 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.078 1.852 . . . . 0.0 112.273 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.705 HD13 ' HB2' ' A' ' 53' ' ' LEU . 96.9 mt -82.12 -17.6 45.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.972 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 74' ' ' LEU . 11.4 mm -73.18 -43.18 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.87 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.4 mt-30 -50.88 -19.54 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.892 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.67 -40.18 29.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.886 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.592 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -70.79 -50.86 31.2 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.494 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.732 ' ND1' HG13 ' A' ' 119' ' ' VAL . 2.2 m-70 -109.08 153.76 42.38 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.572 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.476 ' HG2' HD12 ' A' ' 85' ' ' LEU . 26.1 Cg_endo -61.74 81.0 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.339 2.026 . . . . 0.0 111.789 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.87 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 42.0 33.47 0.37 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.641 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.8 mp -87.63 8.92 23.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.878 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.582 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -75.72 40.42 0.19 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.75 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.18 -12.64 81.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.758 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.754 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.1 ttpt -178.0 34.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.868 0.366 . . . . 0.0 110.668 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.693 HG22 HG22 ' A' ' 119' ' ' VAL . 61.7 mt -80.09 -91.88 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.791 HG22 ' HB2' ' A' ' 74' ' ' LEU . 0.6 OUTLIER -50.85 -40.59 56.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.997 179.694 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.54 53.91 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.144 -1.026 . . . . 0.0 110.916 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.754 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.39 -25.48 33.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.508 -0.346 . . . . 0.0 110.133 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.649 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -59.83 -7.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.742 ' HA ' HD11 ' A' ' 101' ' ' LEU . 1.7 mm? -104.98 27.17 8.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.5 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -168.89 2.18 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.596 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.93 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.385 0.612 . . . . 0.0 111.712 -179.723 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.4 t0 -59.43 -3.05 0.38 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.087 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.59 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 78.63 -29.94 0.15 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.493 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 97' ' ' ASP . 2.1 m -73.61 -27.87 61.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.045 0.45 . . . . 0.0 109.956 178.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.93 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -79.77 -23.48 42.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.097 177.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.742 HD11 ' HA ' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -75.16 -25.23 58.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.833 176.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.6 mp -88.4 -45.56 9.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.085 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.407 ' CD2' ' HE2' ' A' ' 114' ' ' LYS . 1.2 t60 -61.94 -45.95 91.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.759 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.636 ' HE1' ' HB3' ' A' ' 93' ' ' LEU . 0.5 OUTLIER -54.09 -32.74 55.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.409 -179.574 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.718 HD22 HD23 ' A' ' 70' ' ' LEU . 66.5 mt -85.13 -11.68 54.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.801 0.334 . . . . 0.0 111.154 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -110.18 -6.12 15.16 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.529 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -146.8 140.18 14.86 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.678 -0.409 . . . . 0.0 112.064 -178.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.01 3.69 6.41 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.668 2.246 . . . . 0.0 112.056 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -122.01 -22.61 5.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.536 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.529 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.2 p -64.35 -56.94 11.03 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 109.959 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 54' ' ' THR . 6.9 tt -51.64 -28.3 13.99 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.734 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.592 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 7.9 ttt85 -89.86 -60.82 1.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.08 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.42 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 50.3 m -55.65 -34.99 65.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.075 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.553 ' HD3' ' HB3' ' A' ' 100' ' ' GLU . 9.1 mttm -79.2 -32.99 44.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.714 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.674 HG11 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -66.54 -53.61 33.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 177.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.527 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -56.89 -35.72 69.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.375 178.166 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.09 -30.16 60.84 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.948 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.98 -19.64 61.85 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.615 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.732 HG13 ' ND1' ' A' ' 82' ' ' HIS . 18.1 t -68.49 -49.16 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.674 176.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.2 -27.38 63.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.603 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.553 HG12 ' HE2' ' A' ' 92' ' ' MET . 7.7 t -85.32 -31.92 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.477 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.55 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.99 -41.92 73.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.826 178.697 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.491 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mm100 -68.82 -27.92 66.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.413 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.891 179.065 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.634 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.735 0.302 . . . . 0.0 110.844 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.565 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -173.51 -174.27 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.278 178.42 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.568 ' HA ' HD13 ' A' ' 58' ' ' LEU . . . -49.66 -42.13 44.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.793 -178.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.779 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 49.8 m -59.24 -52.3 66.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 110.679 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.779 ' HE2' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -57.8 -40.24 79.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.639 HD12 HD23 ' A' ' 105' ' ' LEU . 13.9 mt -61.65 -44.33 97.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.048 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -16.53 51.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.976 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.2 t -73.93 -7.03 50.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.194 179.886 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.469 ' C ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.917 0.389 . . . . 0.0 110.912 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.552 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.32 24.16 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.111 179.746 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -131.72 -52.82 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.526 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -77.62 15.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.296 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -88.86 -28.86 20.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.266 0.555 . . . . 0.0 110.139 179.267 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.883 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -132.77 11.61 5.15 Favored Glycine 0 N--CA 1.441 -0.988 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.597 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -130.74 -0.69 4.29 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.526 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.17 -21.3 3.95 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.9 0.381 . . . . 0.0 110.702 179.385 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.802 HD11 HD23 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.09 -15.14 60.16 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.032 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.697 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 3.0 t80 -40.06 -54.6 4.36 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.272 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 12.6 Cg_exo -70.33 -22.59 29.27 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.175 1.916 . . . . 0.0 112.125 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 74' ' ' LEU . 1.0 OUTLIER -79.61 -31.5 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.717 -178.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.76 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 7.0 mm -68.69 -42.44 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.855 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.909 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.1 mt-30 -50.78 -18.26 0.7 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.323 0.582 . . . . 0.0 110.366 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.0 -41.58 20.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.835 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.76 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.5 OUTLIER -69.19 -43.71 73.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.464 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.751 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 3.4 m-70 -118.78 149.38 46.38 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.302 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.416 ' HG2' HD12 ' A' ' 85' ' ' LEU . 20.8 Cg_endo -59.67 77.68 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.299 2.0 . . . . 0.0 111.594 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.909 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 16.3 p 47.02 35.54 3.45 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.87 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.751 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -89.04 2.89 53.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.235 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.583 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -61.26 -114.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.756 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.501 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 63.39 -1.37 2.19 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.121 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.615 ' HB3' HD11 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -175.98 -20.62 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.693 HG23 HG12 ' A' ' 115' ' ' VAL . 69.8 mt -50.17 -84.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -177.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.883 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -53.53 -38.17 63.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.533 0.206 . . . . 0.0 110.949 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.11 -29.81 60.03 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.59 176.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.608 ' O ' HG21 ' A' ' 96' ' ' ILE . 2.3 ttp -76.34 -35.09 58.92 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.072 -0.564 . . . . 0.0 110.021 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.716 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.5 mm? -56.28 -11.02 1.02 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.77 -177.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.605 HD11 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.68 28.25 7.66 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -172.86 2.5 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.827 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.982 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.69 -149.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.433 0.635 . . . . 0.0 111.629 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.589 ' N ' HG12 ' A' ' 96' ' ' ILE . 13.0 t0 -53.16 -10.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.852 176.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.715 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.3 OUTLIER 80.6 -25.08 0.18 Allowed 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.824 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -73.48 -31.02 63.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.982 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -73.18 -33.52 65.47 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.82 177.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.457 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 2.3 tm? -65.72 -24.12 66.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.296 178.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.9 mp -89.51 -48.25 7.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.26 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -37.32 81.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.286 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.683 ' HE1' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -59.72 -35.39 74.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.168 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.639 HD23 HD12 ' A' ' 58' ' ' LEU . 15.3 mt -86.78 -11.3 51.4 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.091 0.472 . . . . 0.0 110.066 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -105.63 -7.89 18.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.37 -175.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.853 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -146.58 131.72 9.05 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.673 0.273 . . . . 0.0 111.595 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.66 2.54 3.93 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.635 2.223 . . . . 0.0 112.257 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -125.37 -16.66 5.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.699 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.853 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.3 OUTLIER -70.64 -46.55 63.07 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.006 0.431 . . . . 0.0 110.326 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.802 HD23 HD11 ' A' ' 74' ' ' LEU . 6.2 tt -54.28 -27.53 35.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.971 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.89 -51.93 5.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.362 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.1 t -64.23 -33.91 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.797 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.516 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 12.7 mmtp -78.93 -30.21 44.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.482 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.693 HG12 HG23 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.78 -50.42 49.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.646 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.489 ' HA ' HG23 ' A' ' 119' ' ' VAL . 5.6 t70 -57.32 -39.23 75.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.411 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -73.04 -29.47 63.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.869 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.54 -23.16 61.72 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.851 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.697 HG13 ' ND1' ' A' ' 82' ' ' HIS . 19.8 t -65.0 -48.65 83.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.588 0 CA-C-O 121.297 0.57 . . . . 0.0 109.687 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.15 -26.73 63.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.546 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.46 ' O ' HG12 ' A' ' 121' ' ' VAL . 10.4 t -84.61 -30.69 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.792 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.615 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.91 -39.57 61.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.797 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.421 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.5 mm100 -65.52 -31.03 71.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.152 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.373 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.177 179.183 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.683 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.762 0.315 . . . . 0.0 110.833 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.627 ' HA ' HD23 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -171.29 -169.25 0.71 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.91 179.143 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -55.59 -30.85 61.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.631 0.253 . . . . 0.0 111.297 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.2 m -67.23 -49.89 62.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.608 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.683 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.28 -39.92 84.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.212 0.529 . . . . 0.0 110.212 178.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.499 ' CD1' ' HA ' ' A' ' 55' ' ' ALA . 12.5 mt -62.7 -45.5 92.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.634 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -15.03 58.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.912 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.3 t -75.29 -10.34 59.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.696 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.52 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.514 179.955 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.984 0.421 . . . . 0.0 110.549 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.509 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -115.92 29.87 7.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.586 179.376 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.539 ' C ' HD12 ' A' ' 70' ' ' LEU . 10.0 mm-40 -137.57 -57.44 0.69 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.499 ' HE3' ' HA ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -74.45 -8.44 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.902 -178.683 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.643 HD21 HD22 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -58.49 -40.73 83.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.679 0.276 . . . . 0.0 111.34 -179.635 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.836 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.72 27.94 3.02 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.451 -0.88 . . . . 0.0 112.579 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -141.2 -0.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.513 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.08 -22.62 2.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.642 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.688 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -72.9 -21.29 60.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.319 178.467 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.515 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -38.29 -57.15 1.89 Allowed Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.533 -178.12 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 55.5 Cg_endo -69.76 -20.31 35.0 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.982 1.788 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 53' ' ' LEU . 65.7 mt -88.75 -19.49 25.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.631 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.715 HG13 ' HB ' ' A' ' 90' ' ' THR . 13.3 mm -73.85 -38.21 49.89 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.628 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.3 mt-30 -53.84 -16.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.923 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -38.47 28.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.973 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.69 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.22 -46.07 57.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.103 0.477 . . . . 0.0 110.715 -179.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.743 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.1 m-70 -111.88 159.15 34.54 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.762 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.762 ' HG2' HD21 ' A' ' 85' ' ' LEU . 36.4 Cg_endo -64.49 75.86 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.264 1.976 . . . . 0.0 111.871 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.628 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.6 OUTLIER 46.52 38.91 6.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.005 -178.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.762 HD21 ' HG2' ' A' ' 83' ' ' PRO . 0.9 OUTLIER -93.83 4.27 54.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.015 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.657 ' HB1' ' HB ' ' A' ' 78' ' ' ILE . . . -76.48 62.91 1.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.178 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -96.6 -8.05 57.52 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.72 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.5 tptt -177.48 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.891 -0.655 . . . . 0.0 110.158 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.67 HG21 HG22 ' A' ' 119' ' ' VAL . 68.1 mt -79.94 -88.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.359 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.836 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -52.7 -39.98 62.51 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.522 0.201 . . . . 0.0 111.014 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.17 -29.56 52.65 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.582 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.72 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.7 ttp -76.75 -33.66 58.1 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.107 -0.547 . . . . 0.0 109.988 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.699 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.6 mm? -59.47 -5.22 0.75 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.702 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.593 HD23 ' HA3' ' A' ' 71' ' ' GLY . 2.1 mm? -110.3 27.33 9.73 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -170.57 3.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.018 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.898 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -150.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.338 0.59 . . . . 0.0 111.512 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.4 t70 -59.52 -3.01 0.39 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.192 177.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 15.4 m120 78.66 -29.72 0.15 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.48 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.4 ' H ' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -73.09 -32.94 65.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.44 . . . . 0.0 109.938 178.136 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.898 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -74.16 -23.83 59.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.876 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.4 HD13 HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -75.18 -24.7 57.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.892 177.168 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.2 mp -90.2 -45.02 9.37 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.324 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -37.13 82.35 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.936 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.592 ' HE3' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -59.61 -35.87 75.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.285 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.643 HD22 HD21 ' A' ' 70' ' ' LEU . 15.5 mt -87.1 -9.07 56.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.07 0.462 . . . . 0.0 110.058 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -108.93 -5.05 16.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.399 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.842 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.7 OUTLIER -148.54 129.52 7.04 Favored Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.673 -179.411 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.18 0.48 3.24 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.849 2.366 . . . . 0.0 112.555 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -126.31 -19.93 4.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.784 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.842 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -64.03 -47.94 78.27 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.325 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' A' ' 54' ' ' THR . 3.8 tt -50.39 -22.86 2.04 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.769 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -94.16 -62.87 1.26 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.196 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.0 t -50.23 -29.42 9.43 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.564 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 14.2 mmtp -81.18 -43.1 19.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.666 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.699 HG23 ' HG ' ' A' ' 93' ' ' LEU . 1.4 t -64.58 -58.2 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.265 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.643 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -51.02 -41.11 59.6 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.886 0.374 . . . . 0.0 110.83 178.425 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 113' ' ' SER . 12.5 mt-10 -71.68 -32.83 68.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.219 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -68.74 -23.05 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.037 178.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.743 HG12 ' ND1' ' A' ' 82' ' ' HIS . 21.2 t -65.28 -47.97 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 109.676 176.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.55 -27.68 64.79 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.482 177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.481 ' O ' HG13 ' A' ' 121' ' ' VAL . 23.3 t -83.54 -32.42 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.693 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.681 HD22 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -72.83 -41.06 65.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.173 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.3 mm100 -61.74 -36.63 81.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.017 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.595 177.837 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.705 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 121.007 0.432 . . . . 0.0 110.998 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.864 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.08 -175.56 4.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.186 179.019 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.555 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -52.94 -32.68 47.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.342 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.566 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 9.3 m -67.19 -49.05 66.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.602 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.587 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.22 -37.04 76.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.318 0.58 . . . . 0.0 110.154 178.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.481 ' CD1' HD23 ' A' ' 105' ' ' LEU . 16.3 mt -64.51 -44.31 91.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.563 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.25 -10.4 41.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.577 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -75.37 -2.92 30.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.831 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 121.3 0.571 . . . . 0.0 110.658 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.481 ' C ' HD12 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.94 19.52 4.82 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.319 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -116.91 -38.44 3.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.355 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.5 mtm -80.76 -7.73 59.47 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.799 HD11 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -60.71 -35.64 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -178.558 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.799 ' H ' HD11 ' A' ' 70' ' ' LEU . . . -143.01 28.26 2.13 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.096 -1.05 . . . . 0.0 112.988 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -139.27 -6.53 1.38 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.778 0.323 . . . . 0.0 111.16 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.502 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.0 tmt_? -127.68 -19.48 4.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.132 0.491 . . . . 0.0 109.898 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.726 HD12 HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -77.78 -26.35 49.69 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.76 178.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.532 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -38.75 -52.71 3.57 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.316 -177.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 14.2 Cg_exo -71.17 -22.78 25.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.289 1.993 . . . . 0.0 112.819 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.705 HD13 ' HB2' ' A' ' 53' ' ' LEU . 58.4 mt -88.02 -23.17 23.87 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.807 HG13 ' HB ' ' A' ' 90' ' ' THR . 5.6 mm -72.16 -37.49 59.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 110.413 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.822 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.7 mt-30 -54.2 -14.75 1.22 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.283 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.12 -36.66 22.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.843 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -72.43 -35.27 68.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.015 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.685 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.2 m-70 -121.91 162.09 38.86 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 -179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.07 72.3 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.625 2.217 . . . . 0.0 111.948 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.822 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 51.11 24.76 2.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.287 -179.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.421 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 9.1 mt -85.39 5.15 32.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.936 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.705 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -83.01 47.55 1.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.259 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -91.76 12.47 69.33 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.004 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.938 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 5.1 ttpt -177.58 -13.51 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.697 HD11 HG21 ' A' ' 119' ' ' VAL . 36.7 mt -49.85 -82.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.807 ' HB ' HG13 ' A' ' 78' ' ' ILE . 0.5 OUTLIER -53.49 -38.12 63.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.509 0.195 . . . . 0.0 110.786 -178.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.65 -28.85 65.95 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.48 176.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.938 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.5 ttm -75.85 -38.24 58.19 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.458 0.647 . . . . 0.0 109.885 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.583 HD12 ' HE3' ' A' ' 104' ' ' MET . 4.5 mm? -54.7 -9.55 0.35 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.486 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.779 ' HA ' HD13 ' A' ' 101' ' ' LEU . 5.0 mp -105.74 28.55 7.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -172.43 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.407 -178.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.963 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.32 -150.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.323 0.583 . . . . 0.0 111.734 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.495 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -57.72 -5.7 0.42 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.858 177.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.547 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-20 79.62 -25.63 0.18 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.236 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.4 50.78 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.963 ' HB2' HG13 ' A' ' 96' ' ' ILE . 3.9 mt-10 -76.07 -24.28 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.776 177.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.779 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -75.2 -26.03 58.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.023 177.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 mp -90.72 -44.95 9.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.038 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.53 -41.65 96.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.04 -178.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.925 ' HE1' HD23 ' A' ' 111' ' ' LEU . 7.0 ptm -56.75 -37.5 71.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.812 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 70' ' ' LEU . 56.5 mt -80.44 -11.61 59.66 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.232 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -4.4 14.38 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.747 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -144.2 134.65 12.08 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.164 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 7.8 Cg_exo -72.92 3.55 4.37 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.984 2.456 . . . . 0.0 111.671 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' A' ' 113' ' ' SER . 28.5 mt-10 -126.15 -14.41 6.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.656 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.747 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -76.28 -47.21 24.57 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.925 HD23 ' HE1' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.78 -40.4 13.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.429 176.114 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.551 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 0.3 OUTLIER -81.88 -65.53 1.0 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.573 -179.44 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -47.43 -49.72 24.52 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -178.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.66 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.5 mmtp -64.24 -30.96 71.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.193 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.678 HG11 HG22 ' A' ' 89' ' ' ILE . 1.4 t -70.78 -56.48 10.64 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.068 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.123 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.625 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.3 OUTLIER -54.91 -35.68 64.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.021 0.438 . . . . 0.0 110.408 178.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.97 -32.05 61.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.088 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -68.4 -28.99 67.58 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.835 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.697 HG21 HD11 ' A' ' 89' ' ' ILE . 19.7 t -59.68 -49.02 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.158 0.504 . . . . 0.0 109.787 177.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.37 -25.92 51.21 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.701 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.487 ' O ' HG13 ' A' ' 121' ' ' VAL . 9.9 t -86.64 -30.77 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.846 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.714 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.09 -41.02 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.996 179.275 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.463 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 15.1 mm100 -65.27 -35.06 79.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.004 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.52 177.678 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.817 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.785 0.326 . . . . 0.0 111.022 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.872 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.94 -174.95 3.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.585 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.569 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -50.51 -31.14 14.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.61 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -67.96 -46.85 70.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.865 0.364 . . . . 0.0 110.473 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.802 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.13 -38.12 75.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.787 178.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.66 ' HG ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -64.71 -43.52 93.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 178.159 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.89 -2.07 13.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.088 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.469 ' HB2' ' O ' ' A' ' 57' ' ' MET . 74.5 m -86.0 -8.5 57.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.886 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.336 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 179.392 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.474 ' O ' HD21 ' A' ' 70' ' ' LEU . 2.9 tt0 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.862 0.363 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -123.14 37.56 4.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.935 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.4 ' C ' ' H ' ' A' ' 70' ' ' LEU . 6.4 tt0 -128.19 -50.26 1.31 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.679 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.544 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 15.4 mtm -74.46 10.17 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 111.726 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.66 HD23 ' HG ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -74.57 -62.34 1.56 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.58 0.705 . . . . 0.0 110.391 -179.562 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.86 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -114.66 16.6 18.86 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 112.393 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.54 -8.18 4.63 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.544 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -125.97 -17.56 5.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.005 0.431 . . . . 0.0 110.816 -179.582 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.623 ' HA ' HD22 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.09 -10.98 59.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.633 -179.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.461 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 10.4 t80 -49.13 -54.04 32.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.771 -178.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.512 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 44.0 Cg_endo -67.29 -13.61 40.04 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.031 1.821 . . . . 0.0 112.079 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.817 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.0 mm? -86.39 -42.63 13.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.299 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.673 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.3 mm -60.95 -40.5 85.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.851 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.854 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -47.81 -20.45 0.3 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.024 -179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.21 -42.4 15.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.852 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.627 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -68.78 -39.98 79.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.62 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.517 ' CE1' ' CG2' ' A' ' 119' ' ' VAL . 6.2 m170 -123.5 155.82 65.13 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.932 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.21 77.22 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 0.0 111.958 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.854 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 41.36 30.06 0.12 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.719 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.478 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.7 OUTLIER -85.41 8.38 19.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.779 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.673 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.56 12.55 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.874 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -52.95 -22.22 11.96 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.049 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.714 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -161.34 26.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.907 0.384 . . . . 0.0 111.275 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.73 HG23 HG21 ' A' ' 119' ' ' VAL . 62.8 mt -80.77 -87.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.199 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.86 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.91 -39.31 58.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.224 -179.42 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.15 -31.38 61.94 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.033 -1.08 . . . . 0.0 110.632 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.714 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.9 ttp -74.9 -34.31 62.16 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.081 -0.559 . . . . 0.0 110.083 177.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.6 mm? -58.37 -7.12 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.249 -177.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.6 mp -111.62 29.06 8.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 176.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 11.0 pt-20 -167.99 0.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.038 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.997 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.73 -148.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.488 0.661 . . . . 0.0 111.382 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.588 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -57.74 -6.29 0.5 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.7 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.74 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 78.57 -31.58 0.15 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.276 -179.302 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.7 m -67.52 -29.69 69.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.885 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.997 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -74.86 -35.52 62.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.107 177.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.691 ' HG ' HD13 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -65.32 -30.04 70.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.03 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.691 HD13 ' HG ' ' A' ' 101' ' ' LEU . 5.4 mp -81.79 -47.65 12.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.352 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -43.64 92.01 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.529 -177.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.7 ' HE3' HD23 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -55.92 -34.16 65.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.625 -179.078 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.572 HD23 ' SD ' ' A' ' 104' ' ' MET . 21.2 mt -86.25 -11.4 52.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.841 0.353 . . . . 0.0 110.933 -179.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.24 -6.52 17.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -177.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.762 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.37 139.12 16.16 Favored Pre-proline 0 C--N 1.332 -0.184 0 C-N-CA 120.454 -0.498 . . . . 0.0 112.153 -178.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.475 ' O ' HG23 ' A' ' 54' ' ' THR . 72.1 Cg_endo -75.78 2.81 6.6 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.606 2.204 . . . . 0.0 111.778 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -125.52 -12.95 6.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.345 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.762 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.69 -46.22 19.57 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 177.585 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.872 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.46 -40.62 18.69 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.393 176.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.627 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 2.1 ttt85 -79.32 -61.42 2.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.359 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 28.7 t -50.21 -53.13 30.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -178.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 3.7 mmtp -60.11 -29.8 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.373 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.551 HG22 ' HG ' ' A' ' 93' ' ' LEU . 2.0 t -72.91 -62.14 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.092 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.64 ' HA ' HG23 ' A' ' 119' ' ' VAL . 7.7 t0 -49.23 -35.12 16.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.995 0.426 . . . . 0.0 110.749 178.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -43.53 61.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.448 178.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.473 ' CB ' HD23 ' A' ' 93' ' ' LEU . . . -62.12 -22.31 65.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.998 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.73 HG21 HG23 ' A' ' 89' ' ' ILE . 57.9 t -65.35 -45.88 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.688 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.87 -27.34 65.08 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.428 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.422 ' O ' HG13 ' A' ' 121' ' ' VAL . 22.4 t -83.07 -33.2 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.477 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.592 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.41 -38.95 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.959 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -67.48 -28.69 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.019 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.204 179.074 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.706 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.838 0.352 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.62 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.69 -163.29 0.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.451 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.561 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -57.84 -40.24 79.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.447 -179.01 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.439 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 63.2 m -58.69 -45.69 88.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.871 0.367 . . . . 0.0 110.533 179.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.706 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.83 -42.2 97.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.28 178.687 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.609 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 0.0 OUTLIER -58.21 -47.29 83.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.57 178.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.67 -10.35 51.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.326 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' MET . 41.5 t -82.45 -7.1 59.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.022 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.58 179.993 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.463 0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 24.06 13.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.86 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.49 ' C ' HD11 ' A' ' 70' ' ' LEU . 1.6 mt-30 -118.62 -53.88 2.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.357 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.609 ' HE1' ' HA ' ' A' ' 58' ' ' LEU . 4.4 ptt? -81.08 3.82 22.0 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.717 HD13 ' H ' ' A' ' 71' ' ' GLY . 0.0 OUTLIER -65.21 -42.44 93.5 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.048 179.7 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.832 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -132.22 34.48 2.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.327 -0.939 . . . . 0.0 112.83 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.51 -3.43 0.72 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.959 0.409 . . . . 0.0 111.196 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -128.48 -21.56 3.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.117 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.68 HD12 HD21 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.59 -18.71 58.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.365 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.455 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -44.61 -56.14 9.0 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.97 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.456 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 60.0 Cg_endo -71.76 -8.96 24.1 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.054 1.836 . . . . 0.0 112.092 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.503 HD12 ' HB2' ' A' ' 53' ' ' LEU . 73.2 mt -97.34 -24.32 15.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.397 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -69.56 -36.91 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 177.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.817 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.5 mt-30 -51.6 -15.63 0.49 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.364 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -81.77 -42.61 19.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.611 178.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.697 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.75 -30.63 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.374 179.21 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.657 ' ND1' HD13 ' A' ' 89' ' ' ILE . 15.1 m170 -124.73 156.89 67.67 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.848 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.803 ' HD2' HD11 ' A' ' 85' ' ' LEU . 12.4 Cg_exo -67.7 73.86 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.297 1.998 . . . . 0.0 110.465 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.817 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.3 t 45.0 34.06 1.17 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.112 -177.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.803 HD11 ' HD2' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -84.73 2.6 41.25 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.329 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -77.07 60.89 1.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.81 -8.94 61.58 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 177.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.679 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.4 ttpt -176.49 30.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.14 -0.53 . . . . 0.0 110.54 179.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.733 HG22 HG12 ' A' ' 115' ' ' VAL . 64.2 mt -80.2 -90.81 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.323 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.832 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.48 -42.8 55.1 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.122 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.06 -32.7 50.13 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.304 -0.95 . . . . 0.0 111.137 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.679 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -85.08 -21.32 29.39 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 120.812 0.339 . . . . 0.0 110.405 179.175 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.671 ' HG ' HG21 ' A' ' 115' ' ' VAL . 4.0 mm? -61.48 -6.41 2.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.953 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.652 HD13 ' HA3' ' A' ' 71' ' ' GLY . 3.1 mp -104.56 24.8 11.12 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.038 176.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.483 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.6 pt-20 -165.85 0.7 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.559 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.913 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.5 -153.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.519 0.676 . . . . 0.0 111.93 -179.593 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.44 ' N ' HG12 ' A' ' 96' ' ' ILE . 2.2 t70 -58.98 -3.92 0.41 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.17 177.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.632 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.84 -35.06 0.14 Allowed 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.156 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.5 m -66.14 -26.91 67.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.794 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.913 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -83.4 -24.68 31.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.503 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.678 ' HB2' HD12 ' A' ' 96' ' ' ILE . 2.2 tm? -74.86 -26.25 59.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.546 176.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.8 mp -88.75 -46.1 9.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.422 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.469 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -68.02 -36.25 79.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.644 -177.866 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.657 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 7.0 ptm -60.8 -34.92 75.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 110.941 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.495 HD12 HD23 ' A' ' 70' ' ' LEU . 27.5 mt -84.32 -13.77 51.51 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.799 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.469 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.67 -10.67 16.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.849 -177.75 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -139.37 131.88 15.33 Favored Pre-proline 0 C--N 1.33 -0.258 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.969 -178.665 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.484 ' HA ' ' HB ' ' A' ' 54' ' ' THR . 7.1 Cg_exo -73.35 7.81 2.06 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.976 2.45 . . . . 0.0 111.859 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -127.59 -27.65 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.254 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.821 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.47 -49.26 74.34 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.68 HD21 HD12 ' A' ' 74' ' ' LEU . 5.8 tt -50.43 -32.9 19.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.31 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -59.32 2.34 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.379 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -57.28 -34.15 68.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.815 0.341 . . . . 0.0 111.175 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 20.0 mmtt -78.76 -29.2 45.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.354 179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.733 HG12 HG22 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.46 -53.14 23.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.65 ' HA ' HG22 ' A' ' 119' ' ' VAL . 22.8 t0 -56.85 -36.21 69.75 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.944 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -34.76 60.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.901 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.603 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -63.69 -29.94 71.1 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.446 177.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.65 HG22 ' HA ' ' A' ' 116' ' ' ASP . 23.6 t -55.46 -57.34 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.795 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.405 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -52.25 -24.51 7.44 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.416 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.452 ' O ' HG13 ' A' ' 121' ' ' VAL . 10.7 t -87.02 -31.93 6.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.715 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.7 -43.12 66.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.918 178.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.536 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -67.06 -31.44 71.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.107 178.879 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.205 179.262 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.603 HD13 ' SD ' ' A' ' 69' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.881 0.372 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.867 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -170.96 -177.14 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.968 178.308 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.529 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -50.84 -34.43 27.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.492 ' HG ' ' HE2' ' A' ' 57' ' ' MET . 0.3 OUTLIER -68.4 -48.36 64.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.917 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.492 ' HE2' ' HG ' ' A' ' 56' ' ' SER . 0.0 OUTLIER -57.89 -41.12 81.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.194 0.521 . . . . 0.0 110.043 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.637 HD12 HD21 ' A' ' 105' ' ' LEU . 6.6 mt -63.91 -44.44 92.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.595 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -9.84 11.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.002 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.7 m -84.15 -8.84 58.97 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.999 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.506 179.72 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.486 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.484 ' H ' ' HG2' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -99.26 34.91 2.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.1 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.518 ' C ' HD11 ' A' ' 70' ' ' LEU . 49.4 mm-40 -133.17 -49.84 0.87 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.145 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.603 ' SD ' HD13 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -79.49 -7.73 58.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.909 -178.652 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -60.95 -34.56 74.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.658 0.266 . . . . 0.0 111.477 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.637 ' HA3' HD13 ' A' ' 94' ' ' LEU . . . -138.61 28.69 2.64 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.798 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -137.62 -7.31 1.7 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.866 0.365 . . . . 0.0 111.139 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -19.98 4.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.217 0.532 . . . . 0.0 109.837 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.639 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -78.44 -31.41 48.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.65 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.473 ' HD1' ' HA ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -40.27 -53.49 5.23 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.142 -177.355 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 42.9 Cg_endo -68.21 -21.42 42.0 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.951 1.768 . . . . 0.0 112.138 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 53' ' ' LEU . 92.0 mt -88.61 -19.76 25.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.316 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.741 HG13 ' HB ' ' A' ' 90' ' ' THR . 20.8 mm -71.73 -35.99 57.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.91 0.386 . . . . 0.0 110.135 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.477 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.1 OUTLIER -53.35 -17.15 1.66 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.424 0.63 . . . . 0.0 109.895 177.548 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.08 -38.57 27.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.621 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.582 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -69.8 -42.14 74.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.586 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.766 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.5 m-70 -122.25 152.0 59.89 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.953 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.488 ' HG2' HD13 ' A' ' 85' ' ' LEU . 19.8 Cg_endo -57.45 82.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.358 2.038 . . . . 0.0 111.565 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.477 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 14.1 t 40.16 37.63 0.42 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.416 -178.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.718 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -91.54 7.4 41.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.02 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.585 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -78.84 44.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.586 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.43 -11.64 84.94 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.536 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.626 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -175.57 32.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.687 HG23 HG11 ' A' ' 115' ' ' VAL . 70.7 mt -80.49 -89.44 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.026 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.741 ' HB ' HG13 ' A' ' 78' ' ' ILE . 0.6 OUTLIER -50.17 -42.18 50.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.258 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.45 -31.44 57.12 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.078 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.635 ' O ' HG22 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -83.96 -23.51 31.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 115.561 -0.319 . . . . 0.0 110.145 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.756 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.4 mm? -60.7 -9.06 3.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.403 178.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.703 ' HA ' HD11 ' A' ' 101' ' ' LEU . 4.8 mp -105.1 26.51 9.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 4.8 pt-20 -167.79 1.11 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.3 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.949 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.82 -154.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.486 0.66 . . . . 0.0 111.792 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.42 ' C ' ' H ' ' A' ' 99' ' ' SER . 6.3 t0 -59.54 -2.82 0.38 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.201 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.533 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.79 -35.25 0.17 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.127 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.455 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -67.02 -25.82 66.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.89 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.949 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.9 mt-10 -84.18 -24.08 30.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.631 177.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.703 HD11 ' HA ' ' A' ' 94' ' ' LEU . 1.4 tp -74.82 -27.21 60.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.388 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -88.1 -47.86 8.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.091 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.455 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -63.81 -40.9 97.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.53 -178.586 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.921 ' HE2' HD23 ' A' ' 111' ' ' LEU . 7.7 ptm -56.4 -39.03 72.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.562 0.22 . . . . 0.0 111.218 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.637 HD21 HD12 ' A' ' 58' ' ' LEU . 4.5 mt -85.82 -7.55 58.66 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.167 0.508 . . . . 0.0 110.284 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -109.38 -6.51 15.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.966 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.713 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -147.06 129.79 7.87 Favored Pre-proline 0 C--N 1.328 -0.348 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.691 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.9 Cg_exo -67.78 1.32 3.35 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.78 2.32 . . . . 0.0 112.055 179.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.4 -11.22 6.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.527 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.713 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.92 -45.51 23.85 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.172 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.921 HD23 ' HE2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -46.59 -41.12 14.03 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.614 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.582 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 2.4 ttt180 -79.29 -62.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.306 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.4 t -49.74 -54.34 19.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.342 . . . . 0.0 111.221 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.774 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.2 mmtt -58.88 -29.84 67.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.338 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.687 HG11 HG23 ' A' ' 89' ' ' ILE . 1.4 t -73.92 -55.45 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.076 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.636 ' HA ' HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -55.46 -33.15 63.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.059 0.457 . . . . 0.0 110.594 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -39.24 50.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.551 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -61.28 -24.37 66.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.821 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.766 HG12 ' ND1' ' A' ' 82' ' ' HIS . 15.6 t -66.82 -50.96 60.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.926 177.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.26 -24.96 58.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.655 177.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 121' ' ' VAL . 8.4 t -85.57 -32.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.635 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.61 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.35 -36.61 60.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.077 179.331 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.78 -39.44 94.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.41 177.504 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.7 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.848 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.88 179.14 5.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.709 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.608 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -48.39 -40.23 25.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.524 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.863 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 70.7 m -58.55 -47.96 82.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.975 0.417 . . . . 0.0 110.538 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.863 ' HE2' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.14 -42.93 86.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.179 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.608 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.1 OUTLIER -59.64 -45.33 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.809 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.92 -12.16 34.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.338 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 m -76.46 -11.41 59.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.313 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.406 179.916 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.464 ' C ' HD21 ' A' ' 70' ' ' LEU . 1.9 mt-30 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 120.864 0.364 . . . . 0.0 111.348 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.477 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.89 28.79 4.49 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.714 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -131.92 -58.76 0.96 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.077 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.742 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 0.1 OUTLIER -80.7 24.13 0.49 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.614 ' HB3' HD23 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -87.84 -42.61 12.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.39 0.614 . . . . 0.0 109.717 178.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.671 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -118.77 11.93 11.98 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.057 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -125.67 3.1 7.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.735 -0.232 . . . . 0.0 111.517 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.742 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.16 -33.02 2.68 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.957 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.816 ' HB2' HG23 ' A' ' 90' ' ' THR . 2.6 mm? -56.84 -32.8 66.13 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.865 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 4.8 t80 -34.13 -62.58 0.37 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -173.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.865 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.9 Cg_exo -64.25 -17.96 61.58 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.906 1.737 . . . . 0.0 112.281 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.7 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.1 mt -98.53 -18.62 18.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.901 -0.591 . . . . 0.0 112.276 -177.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 74' ' ' LEU . 8.7 mm -72.73 -46.44 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.937 0.399 . . . . 0.0 110.492 179.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.559 ' HG2' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -52.65 -17.34 1.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.178 178.5 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.61 -37.41 36.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.712 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.469 ' HE2' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -74.31 -49.27 23.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.813 -179.321 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.686 ' ND1' HG13 ' A' ' 119' ' ' VAL . 1.9 m-70 -107.72 159.39 30.54 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.418 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.618 ' HD2' HD13 ' A' ' 85' ' ' LEU . 19.9 Cg_exo -65.39 72.17 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.524 2.15 . . . . 0.0 111.904 179.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.559 HG23 ' HG2' ' A' ' 79' ' ' GLN . 1.6 m 49.03 39.44 14.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.933 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.618 HD13 ' HD2' ' A' ' 83' ' ' PRO . 14.9 mt -95.83 9.15 41.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.276 -179.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.599 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.11 -140.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.718 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.438 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.27 -12.66 30.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.581 -0.819 . . . . 0.0 111.897 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.0 OUTLIER -156.63 -23.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.707 HG21 HG13 ' A' ' 115' ' ' VAL . 56.9 mt -50.33 -84.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.227 -0.115 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.816 HG23 ' HB2' ' A' ' 74' ' ' LEU . 0.4 OUTLIER -55.34 -36.84 66.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.674 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.03 -29.23 59.16 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.681 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.4 ttp -76.45 -35.65 58.36 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.019 -0.591 . . . . 0.0 109.672 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.61 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.6 mm? -58.62 -6.93 0.81 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.72 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.626 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 mm? -108.14 27.17 9.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -170.78 3.21 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.334 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.886 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -151.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.346 0.593 . . . . 0.0 111.691 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.561 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.57 -2.59 0.36 Allowed 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.092 177.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 71.1 m-20 78.16 -27.84 0.16 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.377 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -31.5 60.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.001 0.429 . . . . 0.0 110.008 178.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.886 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.1 mt-10 -75.32 -23.71 57.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.786 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.634 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.6 OUTLIER -75.04 -23.63 58.15 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.862 177.06 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.4 mp -92.47 -42.45 9.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.266 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.53 -39.55 85.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.273 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.907 ' HE3' HD23 ' A' ' 111' ' ' LEU . 6.3 ptm -57.68 -33.61 68.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.614 HD23 ' HB3' ' A' ' 70' ' ' LEU . 12.6 mt -87.15 -10.54 52.46 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.917 -179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -8.1 14.52 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -177.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.683 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -139.9 132.64 15.04 Favored Pre-proline 0 C--N 1.33 -0.263 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.883 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.461 ' O ' HG23 ' A' ' 54' ' ' THR . 61.1 Cg_endo -72.03 4.56 3.15 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.663 2.242 . . . . 0.0 112.03 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 113' ' ' SER . 65.4 mt-10 -127.3 -13.09 5.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.494 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.683 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.51 -46.91 20.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.907 HD23 ' HE3' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.93 -40.7 14.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.434 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 0.8 OUTLIER -83.58 -66.1 0.93 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.682 -179.253 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 3.9 m -47.06 -47.7 22.58 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.737 0.304 . . . . 0.0 111.429 -178.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 118' ' ' ALA . 9.4 mmtt -64.69 -33.47 76.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.707 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -69.16 -55.05 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.614 ' HA ' HG22 ' A' ' 119' ' ' VAL . 3.3 t70 -54.04 -38.16 64.91 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.95 0.405 . . . . 0.0 110.456 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -75.2 -31.19 60.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.128 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -70.77 -21.21 62.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.946 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.686 HG13 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -67.77 -48.78 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.581 0 N-CA-C 109.479 -0.564 . . . . 0.0 109.479 176.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.6 -22.65 56.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.101 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 43.1 t -86.46 -33.99 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.46 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.556 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.97 -38.68 72.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.606 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -69.67 -28.85 66.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.907 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.97 179.108 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.794 0.33 . . . . 0.0 111.015 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.535 ' HA ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.56 -165.5 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.2 179.321 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.562 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -55.93 -38.21 69.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -60.09 -47.19 86.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.51 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.726 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.17 -43.78 87.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.178 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -57.24 -48.68 78.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.545 178.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.14 -3.58 20.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.402 ' HB3' ' O ' ' A' ' 57' ' ' MET . 36.2 t -88.26 -7.48 56.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.665 -179.92 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.975 0.417 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -105.26 36.51 2.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.51 178.507 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -136.06 -63.56 0.64 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.032 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.469 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 3.3 ptt? -81.44 22.53 0.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.856 ' HG ' HD21 ' A' ' 94' ' ' LEU . 1.2 pt? -79.83 -43.47 22.32 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.889 -0.325 . . . . 0.0 111.18 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.792 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -140.49 31.84 2.2 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.331 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -140.66 -7.83 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.653 0.263 . . . . 0.0 111.241 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.57 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.27 -14.36 5.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.617 ' HB2' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -75.48 -15.61 60.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.212 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -47.29 -56.27 13.05 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.781 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 34.8 Cg_exo -60.35 -11.94 18.38 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.04 1.826 . . . . 0.0 112.272 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.535 HD22 ' HA ' ' A' ' 74' ' ' LEU . 1.7 mm? -98.47 -29.05 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.65 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.755 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.2 mm -65.47 -38.11 81.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 120.773 0.321 . . . . 0.0 111.185 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.916 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 20.2 mt-30 -52.02 -17.72 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.578 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.7 -37.25 22.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.276 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.755 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.24 -35.72 61.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.068 0.461 . . . . 0.0 110.682 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.742 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -126.08 155.84 72.86 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.696 -179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -62.37 74.32 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.493 2.129 . . . . 0.0 111.854 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.916 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.2 p 48.37 31.4 2.72 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.987 -178.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -83.67 4.97 26.26 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.17 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -67.89 -138.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.878 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.24 -16.4 23.41 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.667 -0.777 . . . . 0.0 111.683 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.89 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.7 ttpt -156.02 -20.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.613 HD13 ' HA ' ' A' ' 86' ' ' ALA . 60.0 mt -50.35 -81.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.792 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.27 -39.79 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.513 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.96 -28.11 60.43 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 176.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.89 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.6 ttm -76.71 -38.1 54.94 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.41 0.624 . . . . 0.0 109.617 176.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.746 ' HG ' HG21 ' A' ' 115' ' ' VAL . 4.6 mm? -57.85 -5.82 0.46 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.334 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.856 HD21 ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.6 27.37 9.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.569 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -170.14 1.29 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.211 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.18 -152.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.402 0.62 . . . . 0.0 111.654 -179.793 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.432 ' N ' HG12 ' A' ' 96' ' ' ILE . 1.8 t70 -59.58 -3.22 0.44 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.058 177.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.586 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.15 -34.91 0.16 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 123.733 0.645 . . . . 0.0 111.234 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.414 ' H ' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -67.37 -29.18 68.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.938 178.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -79.67 -26.23 41.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.802 177.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -74.82 -27.17 60.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.618 176.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.88 -46.87 10.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.301 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.9 -39.94 87.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.118 -178.648 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.743 ' HE3' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -56.52 -34.13 66.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.521 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.569 ' N ' ' HG3' ' A' ' 104' ' ' MET . 23.0 mt -85.67 -12.98 49.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.506 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -107.8 -2.05 20.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.37 -177.323 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -150.07 132.64 8.14 Favored Pre-proline 0 CA--C 1.53 0.207 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.6 Cg_exo -68.48 -1.66 7.8 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.933 2.422 . . . . 0.0 112.139 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -116.96 -29.38 6.01 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.057 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -62.11 -42.19 98.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.203 -178.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.743 ' HG ' ' HE3' ' A' ' 104' ' ' MET . 4.8 tt -59.77 -25.39 64.86 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.669 -0.413 . . . . 0.0 111.176 179.303 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.414 ' HG2' ' HE1' ' A' ' 81' ' ' MET . 38.7 mtp180 -95.92 -66.09 0.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.923 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.505 ' OG ' ' HG3' ' A' ' 109' ' ' GLU . 1.5 m -42.82 -33.99 0.86 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.961 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.526 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 38.7 mmtt -81.77 -43.26 18.6 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.144 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.746 HG21 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -60.19 -58.4 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.46 -41.75 53.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.19 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -73.17 -31.07 64.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.066 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -68.29 -27.71 66.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.63 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.742 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.4 t -59.41 -53.15 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.611 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.413 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -54.27 -23.68 15.88 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.065 177.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 121' ' ' VAL . 12.3 t -86.71 -30.96 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.65 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.791 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.51 -41.18 61.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.208 179.059 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.521 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -70.17 -28.71 65.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.401 0.62 . . . . 0.0 110.078 179.156 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.649 179.93 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.804 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.813 0.34 . . . . 0.0 110.972 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.855 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -167.52 -175.42 2.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.305 179.401 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.14 -34.14 21.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.278 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 20.0 m -64.01 -44.79 91.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.627 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.804 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.25 -42.04 97.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.207 178.858 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.567 HD23 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -61.88 -44.5 96.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.759 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.71 -12.41 58.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.292 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.2 m -76.92 -16.77 59.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.059 179.549 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.861 0.362 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.572 ' HA ' HD23 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -117.29 41.33 2.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.743 179.339 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.487 ' C ' HD13 ' A' ' 70' ' ' LEU . 2.0 mt-30 -136.46 -54.66 0.74 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.281 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.499 ' HE1' ' HA ' ' A' ' 58' ' ' LEU . 1.3 ptt? -80.54 -1.84 43.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.784 -178.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.572 HD23 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -61.81 -43.12 99.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.591 0.234 . . . . 0.0 111.559 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.832 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -130.48 28.24 3.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.349 -0.929 . . . . 0.0 112.684 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -140.91 -2.97 1.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 0.0 111.194 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.573 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.35 -23.1 3.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.059 0.457 . . . . 0.0 110.721 -179.819 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.639 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.04 -22.47 59.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.812 -178.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.673 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -44.95 -56.35 9.08 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.968 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.673 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.1 Cg_exo -61.12 -15.14 37.65 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.031 1.821 . . . . 0.0 112.371 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.533 HD12 ' HB2' ' A' ' 53' ' ' LEU . 82.9 mt -98.64 -25.51 14.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.909 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.7 mm -65.23 -38.64 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-O 121.009 0.433 . . . . 0.0 110.667 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.692 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.0 mt-30 -53.64 -14.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.827 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.46 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -88.2 -30.46 19.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.189 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.488 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -84.0 -46.63 11.83 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -173.554 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.784 ' N ' ' HA ' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -80.64 -35.57 0.86 Allowed Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 -171.309 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.784 ' HA ' ' N ' ' A' ' 82' ' ' HIS . 42.1 Cg_endo -96.41 -76.24 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.028 0 CA-C-N 120.65 1.268 . . . . 0.0 112.675 2.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.692 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.9 m -68.08 76.46 0.23 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.696 -178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -145.68 10.33 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.43 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -76.79 42.43 0.3 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.448 -177.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -12.59 64.28 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.045 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.775 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.8 ttpt 177.04 36.9 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.042 0.449 . . . . 0.0 110.091 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.732 HG23 HG21 ' A' ' 119' ' ' VAL . 67.4 mt -79.72 -90.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.169 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.832 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.3 -39.62 57.27 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.26 -32.17 57.1 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.02 -1.085 . . . . 0.0 110.838 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.775 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.69 -25.57 32.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.367 178.637 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.649 HD22 ' O ' ' A' ' 89' ' ' ILE . 4.3 mm? -59.6 -7.92 1.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.732 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.567 HD23 HD12 ' A' ' 70' ' ' LEU . 1.8 mm? -106.19 27.33 8.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.5 pt-20 -166.43 1.53 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.463 -178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.953 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.83 -151.48 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.384 0.611 . . . . 0.0 111.73 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.526 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.2 t0 -59.08 -3.83 0.42 Allowed 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.085 178.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.547 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-80 79.55 -29.03 0.14 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.544 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -32.6 61.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.168 0.509 . . . . 0.0 109.827 178.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.953 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.8 mt-10 -74.08 -23.49 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.999 177.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 1.5 tp -74.86 -25.64 59.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.863 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -88.27 -47.05 8.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.239 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.4 OUTLIER -63.12 -41.26 99.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.055 -178.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.749 ' HE2' HD22 ' A' ' 111' ' ' LEU . 0.6 OUTLIER -56.1 -34.0 65.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.348 -179.736 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.552 ' N ' ' HG3' ' A' ' 104' ' ' MET . 15.0 mt -87.15 -8.63 56.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.039 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 2.6 pt-20 -111.85 -7.98 14.15 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.42 131.7 14.08 Favored Pre-proline 0 C--N 1.331 -0.196 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.782 -179.134 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.7 Cg_exo -67.58 1.2 3.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.808 2.339 . . . . 0.0 112.103 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -127.19 -11.69 5.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.5 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.671 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -75.24 -46.16 35.6 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.292 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.855 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.48 -29.83 3.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.653 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.457 ' HG2' ' HE2' ' A' ' 81' ' ' MET . 55.1 mtt180 -95.22 -64.06 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.076 -179.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.445 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 27.8 t -46.24 -31.56 2.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.967 0.413 . . . . 0.0 109.981 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 118' ' ' ALA . 15.8 mmtm -80.75 -41.05 24.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.88 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.481 HG13 ' CG2' ' A' ' 89' ' ' ILE . 1.5 t -64.38 -63.0 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.305 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.577 ' HA ' HG23 ' A' ' 119' ' ' VAL . 9.6 t70 -48.84 -40.07 27.97 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 111.081 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.0 -35.61 66.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.796 0.332 . . . . 0.0 110.454 179.49 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -64.75 -26.28 68.29 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.834 178.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.732 HG21 HG23 ' A' ' 89' ' ' ILE . 12.9 t -63.79 -47.76 89.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.141 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -55.44 -25.58 37.09 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.455 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.447 HG12 ' HE2' ' A' ' 92' ' ' MET . 3.8 t -87.13 -34.54 7.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.062 177.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.509 ' CD1' ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -65.58 -33.56 76.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.335 178.209 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -79.82 -24.76 41.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.703 177.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 120' ' ' ALA . . . . . . . . 0 CA--C 1.519 -0.243 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.794 178.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.828 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.891 0.377 . . . . 0.0 111.186 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.863 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.95 -168.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.331 179.308 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.542 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -54.79 -38.91 67.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.507 -179.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.467 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 1.2 m -60.42 -45.92 91.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 0.0 110.419 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.828 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.49 -43.14 88.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.065 178.688 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.542 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.15 -48.16 81.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.476 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.01 -2.6 15.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.355 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.7 t -88.99 -6.98 56.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.315 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.717 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -120.58 30.34 6.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.804 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.509 ' C ' HD13 ' A' ' 70' ' ' LEU . 8.8 tt0 -131.69 -53.6 1.0 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.437 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.511 ' SD ' HD23 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -77.26 2.4 15.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.674 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.665 HD12 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -68.4 -39.49 81.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.611 -179.759 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.829 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -136.4 27.76 2.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.591 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -139.59 -10.16 1.22 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.618 0.247 . . . . 0.0 111.27 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.562 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.9 tmt_? -127.35 -14.82 5.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.307 . . . . 0.0 110.774 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.846 HD12 HD12 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.77 -14.63 59.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.484 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.642 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 5.6 t80 -49.39 -55.03 24.35 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.531 -178.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.4 Cg_exo -61.69 -9.35 13.51 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.083 1.855 . . . . 0.0 112.455 -179.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.572 HD22 HD11 ' A' ' 53' ' ' LEU . 1.8 mm? -98.69 -35.41 10.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.699 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.716 HG22 HD11 ' A' ' 89' ' ' ILE . 4.7 mm -60.09 -40.72 84.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.855 0.359 . . . . 0.0 110.601 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.749 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.2 mt-30 -49.19 -19.16 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.879 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.63 -41.63 17.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.908 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.624 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -70.31 -38.72 75.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.331 0.586 . . . . 0.0 110.412 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.517 ' CE1' ' CG2' ' A' ' 119' ' ' VAL . 5.3 m170 -121.71 148.69 51.37 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.442 -177.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.621 ' HD2' HD13 ' A' ' 85' ' ' LEU . 37.8 Cg_exo -60.33 74.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.441 2.094 . . . . 0.0 111.699 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.749 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.7 OUTLIER 48.83 28.33 1.88 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.643 -178.048 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.621 HD13 ' HD2' ' A' ' 83' ' ' PRO . 3.1 mt -80.69 2.41 26.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.146 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.626 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.05 -131.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.585 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.58 -18.55 6.97 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.045 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.835 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.3 ttpt -156.34 -20.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.781 HD13 HG21 ' A' ' 119' ' ' VAL . 70.1 mt -49.81 -79.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.829 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.78 -40.14 69.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.457 0.17 . . . . 0.0 110.824 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.33 -28.39 61.79 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.097 -1.049 . . . . 0.0 110.57 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.835 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.0 ttm -76.12 -36.69 58.72 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.581 0.705 . . . . 0.0 109.79 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.652 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.4 mm? -56.27 -9.47 0.67 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.619 -178.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.778 HD13 HD22 ' A' ' 101' ' ' LEU . 2.4 mm? -106.32 28.34 7.84 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 176.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -170.26 0.35 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.662 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.966 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.88 -148.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.464 0.65 . . . . 0.0 111.493 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.602 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -53.92 -10.14 0.3 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.99 176.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.688 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.5 m-80 79.87 -22.95 0.25 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.099 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -32.35 59.38 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.966 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -70.48 -29.89 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.864 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.778 HD22 HD13 ' A' ' 94' ' ' LEU . 2.2 tm? -69.36 -27.31 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.197 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.4 mp -87.96 -46.58 9.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.348 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.446 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.12 -39.83 90.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.567 -177.821 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.916 ' HE1' HD21 ' A' ' 111' ' ' LEU . 7.3 ptm -57.19 -35.87 70.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.715 0.293 . . . . 0.0 111.122 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 58' ' ' LEU . 12.5 mt -85.7 -10.09 56.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.9 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -109.55 -8.51 14.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.175 -177.515 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.695 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -140.31 131.49 14.12 Favored Pre-proline 0 C--N 1.33 -0.276 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.865 -178.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 14.9 Cg_exo -69.14 2.4 3.21 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.978 2.452 . . . . 0.0 112.029 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -127.3 -11.99 5.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.671 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.695 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -77.16 -45.57 26.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.916 HD21 ' HE1' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.64 -41.21 14.37 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.779 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.624 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 0.3 OUTLIER -80.6 -63.27 1.45 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.296 179.771 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -48.71 -55.11 12.31 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.348 . . . . 0.0 111.076 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.819 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 17.9 mmtt -57.6 -31.28 66.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.652 HG23 ' HG ' ' A' ' 93' ' ' LEU . 1.4 t -70.36 -58.63 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.66 ' HA ' HG22 ' A' ' 119' ' ' VAL . 23.3 t70 -49.62 -38.92 33.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.285 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -43.99 68.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.187 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.416 ' O ' ' HE3' ' A' ' 92' ' ' MET . . . -58.4 -29.05 65.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.936 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.781 HG21 HD13 ' A' ' 89' ' ' ILE . 21.6 t -56.91 -51.5 67.4 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.789 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.02 -26.91 28.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.92 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 121' ' ' VAL . 9.2 t -86.18 -31.03 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.875 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.754 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.92 -40.71 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.908 179.259 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.444 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 16.9 mm100 -61.97 -37.91 86.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.653 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.235 176.641 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.802 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.927 0.394 . . . . 0.0 111.014 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.85 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -164.64 -167.92 1.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.329 179.388 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.553 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -56.84 -37.44 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.093 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.649 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 5.1 m -61.12 -43.61 98.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.389 179.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.802 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -62.26 -41.49 98.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.149 178.55 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.553 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -59.25 -46.13 89.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.546 179.151 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.99 -12.17 61.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.3 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 28.5 t -76.37 -8.63 57.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.832 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.537 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.329 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 121.05 0.452 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.586 ' HA ' HD13 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -130.32 25.08 5.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 179.62 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 40.7 tt0 -130.25 -58.02 1.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.92 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.55 ' SD ' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -74.0 18.02 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.823 HD11 HD22 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.41 -39.46 13.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.119 0.485 . . . . 0.0 110.491 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.962 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -130.74 16.41 5.34 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.198 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -133.84 -11.09 2.67 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.477 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.562 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.77 -14.05 5.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.843 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.82 -12.06 59.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.131 179.392 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.726 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.1 t80 -46.81 -54.29 20.66 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.024 -178.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.726 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.1 Cg_exo -62.67 -15.62 47.54 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.205 1.937 . . . . 0.0 112.286 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.676 HD21 HD12 ' A' ' 53' ' ' LEU . 2.2 mm? -93.25 -28.13 16.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.486 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.766 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.0 mm -70.61 -40.18 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.781 0.324 . . . . 0.0 111.187 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.784 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 17.8 mt-30 -53.29 -16.43 1.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.346 0.593 . . . . 0.0 110.22 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.83 -37.23 22.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.062 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.766 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.17 -35.96 61.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.046 0.45 . . . . 0.0 110.704 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.655 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.9 m-70 -125.24 161.98 46.7 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.861 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.796 ' HG2' HD11 ' A' ' 85' ' ' LEU . 45.7 Cg_endo -67.59 72.16 0.66 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.402 2.068 . . . . 0.0 112.041 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.784 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 66.1 p 46.83 41.89 11.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.356 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.796 HD11 ' HG2' ' A' ' 83' ' ' PRO . 2.3 mp -99.15 11.06 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -71.69 22.33 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.986 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.489 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.04 -17.15 35.74 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.657 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.634 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.3 ttpt -168.95 29.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.816 0.341 . . . . 0.0 111.06 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.629 HD12 HG21 ' A' ' 119' ' ' VAL . 67.5 mt -80.7 -90.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.07 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.962 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -52.04 -41.73 62.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.593 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.07 -32.31 49.64 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.113 -1.042 . . . . 0.0 111.146 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.634 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -85.69 -22.39 27.87 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 120.908 0.385 . . . . 0.0 110.45 179.437 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.624 HD23 ' O ' ' A' ' 89' ' ' ILE . 3.9 mm? -60.22 -10.01 4.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.195 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.619 HD22 ' HA3' ' A' ' 71' ' ' GLY . 2.2 mm? -102.91 26.43 8.13 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.3 pt-20 -165.5 -0.62 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.916 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.993 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.94 -151.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.397 0.618 . . . . 0.0 111.633 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.595 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.7 t0 -53.83 -10.05 0.28 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.151 176.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.718 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.8 OUTLIER 79.16 -23.03 0.26 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.191 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -76.53 -25.98 54.72 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.993 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -77.96 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.779 177.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.804 ' HG ' HD22 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.5 -21.41 66.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.865 178.094 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.804 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -88.68 -52.4 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.23 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.527 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.6 OUTLIER -63.36 -38.75 92.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.223 -178.56 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.693 ' HE2' HD23 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -56.85 -35.1 68.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.743 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.823 HD22 HD11 ' A' ' 70' ' ' LEU . 21.7 mt -86.89 -10.15 54.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.942 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.527 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.18 -4.64 15.65 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -177.029 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.803 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -141.93 130.0 11.81 Favored Pre-proline 0 C--N 1.332 -0.192 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.597 -179.918 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.47 6.25 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.402 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.439 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.4 OUTLIER -131.54 -24.25 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.538 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.803 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.13 -42.62 99.54 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.85 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.76 -28.55 2.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.357 175.706 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.9 mtp85 -95.89 -66.63 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.073 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 22.7 t -44.93 -30.36 0.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.306 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -80.79 -42.27 22.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.953 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.495 HG11 ' HE2' ' A' ' 81' ' ' MET . 1.9 t -64.25 -60.18 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.279 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.584 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.5 OUTLIER -51.31 -39.61 57.25 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.078 179.442 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' A' ' 113' ' ' SER . 2.1 mt-10 -73.21 -33.9 65.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.916 0.388 . . . . 0.0 110.151 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.577 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -67.08 -27.46 67.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.655 HG12 ' ND1' ' A' ' 82' ' ' HIS . 22.0 t -60.57 -47.46 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.05 -25.9 59.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.557 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.512 HG12 ' HE3' ' A' ' 92' ' ' MET . 5.1 t -86.56 -31.26 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.799 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.598 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.6 -40.08 66.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.927 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -64.02 -38.59 91.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.94 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.396 177.221 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.708 ' HB2' HD11 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.863 0.363 . . . . 0.0 111.033 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.895 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -169.8 -177.81 2.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.175 178.312 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -52.32 -35.79 51.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.611 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 5.7 m -66.58 -47.91 71.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.364 . . . . 0.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.611 ' HE2' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.17 -41.98 85.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.258 0.551 . . . . 0.0 110.369 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.483 HD12 HD21 ' A' ' 105' ' ' LEU . 8.1 mt -63.17 -45.94 89.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.812 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.58 -10.34 44.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.488 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -83.15 -8.02 59.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.736 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.182 179.939 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.96 0.41 . . . . 0.0 110.497 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -116.51 36.03 4.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.577 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -126.76 -50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.421 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.471 ' HE1' ' HA ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -80.62 -3.38 50.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.642 -178.668 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.73 HD12 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -61.09 -38.57 86.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.39 -179.767 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.768 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.94 28.91 2.78 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.581 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -142.95 0.18 1.19 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.419 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.37 -22.62 2.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.692 179.157 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.717 ' HB3' ' HG1' ' A' ' 90' ' ' THR . 0.3 OUTLIER -75.98 -24.88 55.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.826 178.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.433 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -41.14 -55.96 4.58 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.044 -177.931 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.433 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.0 Cg_endo -71.48 -15.37 30.94 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.028 1.819 . . . . 0.0 112.232 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.708 HD11 ' HB2' ' A' ' 53' ' ' LEU . 81.3 mt -92.16 -20.64 21.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.524 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.709 HD13 ' HG1' ' A' ' 90' ' ' THR . 8.6 mm -73.08 -36.17 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.69 ' HG2' HG21 ' A' ' 84' ' ' THR . 3.7 mt-30 -52.8 -13.06 0.37 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.097 177.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -84.09 -44.42 14.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.9 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.708 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.45 -35.78 73.53 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.526 0.679 . . . . 0.0 110.164 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.6 ' CE1' HG23 ' A' ' 119' ' ' VAL . 5.5 m170 -119.53 139.91 28.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.944 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' A' ' 82' ' ' HIS . 54.7 Cg_exo -30.98 -48.91 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.82 2.347 . . . . 0.0 112.215 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.69 HG21 ' HG2' ' A' ' 79' ' ' GLN . 0.0 OUTLIER 176.59 14.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.89 177.509 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.457 ' C ' HD12 ' A' ' 89' ' ' ILE . 2.5 mp -66.86 3.87 0.97 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.424 -179.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.584 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.32 47.37 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.247 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.78 -7.32 78.48 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.927 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 4.8 ttpt -174.4 28.35 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.783 0.325 . . . . 0.0 110.977 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.688 HG22 HG11 ' A' ' 115' ' ' VAL . 56.1 mt -80.1 -83.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.757 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.768 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.1 -40.88 59.43 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.476 0.179 . . . . 0.0 110.669 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.14 -31.76 56.46 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.927 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 4.6 ttm -73.8 -39.34 64.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.272 176.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.655 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -54.18 -10.76 0.39 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.843 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 70' ' ' LEU . 1.7 mm? -105.15 28.68 7.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 92' ' ' MET . 7.4 pt-20 -171.52 -0.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.04 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 1.001 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.92 -150.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.488 0.661 . . . . 0.0 111.735 -179.325 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.571 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.7 t70 -55.49 -9.35 0.47 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.204 176.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.712 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.3 m120 79.45 -24.64 0.2 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.103 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -74.32 -29.35 61.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 1.001 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.57 -38.53 62.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.556 176.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 0.3 OUTLIER -64.23 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.986 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.412 ' HA ' HD23 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -87.36 -48.62 7.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.203 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.413 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.1 -41.43 94.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.318 -178.299 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.764 ' HE3' HD23 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -56.32 -34.31 66.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.443 -179.354 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.556 ' N ' ' HG3' ' A' ' 104' ' ' MET . 12.2 mt -86.66 -11.22 51.95 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.797 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.16 -7.99 15.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.737 0.644 . . . . 0.0 112.737 -176.68 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.73 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -141.95 135.73 14.63 Favored Pre-proline 0 C--N 1.332 -0.164 0 C-N-CA 120.598 -0.441 . . . . 0.0 112.008 -178.69 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.473 ' O ' HG21 ' A' ' 54' ' ' THR . 62.5 Cg_endo -72.18 0.52 7.19 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.697 2.265 . . . . 0.0 111.906 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -123.99 -10.89 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.323 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.73 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.81 -46.89 17.75 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.095 0.474 . . . . 0.0 109.737 178.059 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.895 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.5 -39.62 16.49 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.163 176.336 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.421 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.5 ttt-85 -80.18 -59.2 2.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.273 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.421 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 3.3 t -52.66 -56.82 12.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.981 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.549 ' HD3' ' HG3' ' A' ' 100' ' ' GLU . 0.8 OUTLIER -55.21 -32.24 62.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.688 HG11 HG22 ' A' ' 89' ' ' ILE . 1.8 t -69.58 -60.96 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.079 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.525 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.7 OUTLIER -50.24 -36.8 32.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 111.176 178.767 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -38.99 65.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.263 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.503 ' O ' ' HE2' ' A' ' 92' ' ' MET . . . -61.85 -30.02 70.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 177.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.6 HG23 ' CE1' ' A' ' 82' ' ' HIS . 14.6 t -56.2 -53.74 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.933 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.44 -27.07 22.78 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.928 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.449 ' O ' HG11 ' A' ' 121' ' ' VAL . 9.2 t -85.68 -31.71 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.954 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.665 ' HA ' ' HZ2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.82 -43.39 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.815 179.211 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.49 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 18.1 mm100 -68.88 -25.6 64.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.214 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.354 179.264 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.7 ' HB3' HD12 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.007 0.432 . . . . 0.0 111.164 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.533 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.33 -169.06 1.01 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.682 178.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.575 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.52 -40.26 65.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.665 0.269 . . . . 0.0 111.431 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.691 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.5 m -59.27 -51.54 69.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.715 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.691 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.56 -39.11 79.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.296 179.069 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 55' ' ' ALA . 17.8 mt -62.9 -42.89 99.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.89 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.2 -16.72 62.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.148 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.9 m -74.19 -7.21 51.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.357 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.397 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HA ' ' CD2' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.08 25.22 12.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 178.856 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.464 ' C ' HD13 ' A' ' 70' ' ' LEU . 2.2 mm100 -121.58 -50.76 2.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.57 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -81.17 5.97 15.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.92 -178.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.717 HD12 HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.86 -57.27 8.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 179.816 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.747 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -113.05 33.62 5.49 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.732 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -144.41 -3.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.824 0.345 . . . . 0.0 111.297 -178.686 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.638 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -125.68 -26.26 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.527 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.89 ' HB2' HG22 ' A' ' 90' ' ' THR . 1.6 mm? -63.5 -33.14 74.92 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.297 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.79 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.2 t80 -39.2 -60.23 1.27 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.79 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 32.5 Cg_exo -57.92 -19.45 39.8 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 121.851 1.701 . . . . 0.0 112.342 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.671 HD21 ' H ' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -98.83 -25.96 14.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.318 -178.109 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.68 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 5.4 mm -65.85 -40.03 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.758 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -51.5 -19.36 1.4 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.521 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.26 -36.85 26.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.837 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.469 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.79 -34.56 64.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.75 ' ND1' HG12 ' A' ' 119' ' ' VAL . 2.6 m-70 -130.44 148.03 68.3 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.572 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.433 ' HD2' HD11 ' A' ' 85' ' ' LEU . 51.2 Cg_exo -55.65 79.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.537 2.158 . . . . 0.0 112.364 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.758 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.0 p 42.89 37.68 1.17 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.529 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.518 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 10.8 mt -95.66 12.46 29.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.1 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.68 ' HB3' ' HB ' ' A' ' 78' ' ' ILE . . . -76.02 24.16 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.558 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.18 -19.14 44.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.681 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.639 ' HB3' HD12 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -169.11 32.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.89 0.376 . . . . 0.0 111.012 179.681 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.684 HG22 HG12 ' A' ' 115' ' ' VAL . 64.0 mt -80.56 -92.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.888 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.89 HG22 ' HB2' ' A' ' 74' ' ' LEU . 0.6 OUTLIER -50.82 -40.56 56.02 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.01 -31.33 55.78 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.209 -0.996 . . . . 0.0 110.973 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.717 ' HG2' HG22 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -84.79 -22.16 29.67 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 120.864 0.364 . . . . 0.0 110.098 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.63 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.4 mm? -62.48 -4.41 1.9 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.195 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.717 HD13 HD12 ' A' ' 70' ' ' LEU . 3.1 mp -106.61 24.32 12.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.42 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 10.5 pt-20 -166.8 0.83 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.481 -178.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.908 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -152.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.554 0.693 . . . . 0.0 111.797 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.452 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.4 t0 -59.27 -3.28 0.38 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.157 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.603 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.62 -34.07 0.14 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.244 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.463 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -69.18 -24.79 64.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.102 178.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.908 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.3 mt-10 -84.04 -27.05 28.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.427 177.253 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.669 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.1 OUTLIER -74.89 -27.48 60.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.246 175.886 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' A' ' 102' ' ' LEU . 0.9 OUTLIER -83.92 -48.79 9.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.873 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.513 ' ND1' ' HB3' ' A' ' 110' ' ' SER . 0.2 OUTLIER -61.93 -47.74 83.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.422 -178.57 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.669 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 5.7 ptm -52.15 -36.44 51.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.455 -178.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.684 HD13 HD23 ' A' ' 70' ' ' LEU . 54.4 mt -81.83 -14.71 55.94 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.857 -179.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.2 -10.61 16.38 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -176.934 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.513 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -143.2 136.27 13.86 Favored Pre-proline 0 N--CA 1.465 0.278 0 C-N-CA 120.283 -0.567 . . . . 0.0 112.241 -178.62 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 7.6 Cg_exo -73.69 3.88 4.52 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.017 2.478 . . . . 0.0 112.156 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -123.99 -22.07 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.561 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.513 ' HB3' ' ND1' ' A' ' 103' ' ' HIS . 2.4 p -64.05 -55.97 18.32 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.377 0.608 . . . . 0.0 109.857 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.547 HD12 HD23 ' A' ' 74' ' ' LEU . 7.5 tt -48.8 -31.09 6.48 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.572 -179.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.411 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 7.2 ttt85 -88.17 -60.56 1.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.308 -179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.6 m -56.5 -34.75 67.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.122 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.585 ' O ' ' HB1' ' A' ' 118' ' ' ALA . 6.5 mmtp -78.5 -31.22 47.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.78 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.684 HG12 HG22 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.77 -51.71 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.31 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.665 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -58.43 -32.96 69.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.336 177.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -79.58 -31.07 41.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.574 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.612 ' O ' ' HE3' ' A' ' 92' ' ' MET . . . -68.32 -23.77 64.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.492 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.75 HG12 ' ND1' ' A' ' 82' ' ' HIS . 17.0 t -64.86 -57.24 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.609 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.414 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -53.27 -23.78 9.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.885 177.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 121' ' ' VAL . 24.2 t -86.62 -32.54 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.433 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.639 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.68 -43.87 65.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.234 179.207 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.534 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -66.19 -31.5 72.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.829 178.327 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.139 179.133 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.777 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.824 0.345 . . . . 0.0 110.841 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.628 ' HA ' HD23 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -169.44 -161.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.37 179.229 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.572 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -58.26 -35.38 71.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.394 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.781 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 72.9 m -60.39 -49.43 77.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.223 179.156 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.781 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.22 -42.34 86.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.306 178.659 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.572 HD21 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.93 -45.11 91.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.815 179.459 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.27 -16.07 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.337 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.5 t -75.95 -13.52 60.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.744 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.993 179.497 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.9 0.381 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.87 39.69 3.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.785 179.55 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.468 ' C ' HD12 ' A' ' 70' ' ' LEU . 1.2 mt-30 -135.82 -59.27 0.76 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.371 -179.572 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.487 ' HE3' ' HA ' ' A' ' 58' ' ' LEU . 5.5 ptt? -79.89 12.48 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.859 -178.634 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.699 HD11 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -76.62 -40.56 48.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.748 0.309 . . . . 0.0 111.077 179.052 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.784 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -133.7 23.98 3.72 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.224 -0.989 . . . . 0.0 112.693 -179.276 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.61 -7.37 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.708 0.29 . . . . 0.0 111.225 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.56 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.8 tmt_? -127.13 -15.25 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.906 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.62 ' HB2' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -77.11 -8.86 58.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.228 179.524 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.707 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.1 t80 -50.02 -55.82 21.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.445 -178.516 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.707 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 19.9 Cg_exo -64.89 -9.64 22.11 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.057 1.838 . . . . 0.0 111.852 179.513 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.777 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.9 mm? -93.22 -34.21 13.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.365 -179.52 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.765 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.5 mm -66.74 -38.87 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.872 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.698 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.4 mt-30 -50.93 -18.25 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.444 0.64 . . . . 0.0 110.198 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -83.82 -43.11 15.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.225 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.765 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.71 -38.73 73.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.427 0.632 . . . . 0.0 110.424 -179.898 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.663 ' CE1' HG22 ' A' ' 119' ' ' VAL . 3.9 m170 -121.95 151.24 57.75 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.414 -177.132 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.826 ' HG2' HD23 ' A' ' 85' ' ' LEU . 30.5 Cg_endo -62.58 75.82 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.272 1.982 . . . . 0.0 111.778 179.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.698 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 50.43 28.85 3.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.743 -178.786 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.826 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -80.22 0.62 31.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.375 -178.897 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.625 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.78 -144.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.47 -3.58 86.12 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.915 -179.441 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.578 ' HZ3' ' HG3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -167.82 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.778 -0.211 . . . . 0.0 111.111 -179.826 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.643 HD11 ' ND1' ' A' ' 82' ' ' HIS . 76.6 mt -49.68 -82.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.689 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.784 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -55.57 -38.12 68.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.597 0.237 . . . . 0.0 110.729 179.748 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.54 -29.05 57.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.686 177.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.641 ' O ' HG22 ' A' ' 96' ' ' ILE . 2.3 ttp -76.88 -33.62 57.82 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.098 -0.551 . . . . 0.0 109.876 177.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.651 ' HG ' HG21 ' A' ' 115' ' ' VAL . 4.6 mm? -59.86 -5.2 0.88 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.642 -178.215 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.616 HD11 ' HA3' ' A' ' 71' ' ' GLY . 3.2 mp -109.08 25.78 11.4 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 176.483 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -169.91 3.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.289 -178.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.92 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.06 -151.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.242 0.544 . . . . 0.0 111.66 -179.752 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 6.3 t0 -59.53 -2.48 0.34 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.206 178.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.559 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-80 78.0 -28.74 0.16 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.443 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.6 m -75.32 -27.05 59.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.054 0.454 . . . . 0.0 109.888 178.092 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.92 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -80.41 -22.19 41.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.938 177.916 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.532 HD21 HD12 ' A' ' 94' ' ' LEU . 2.1 tm? -75.2 -24.98 57.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.723 176.73 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.3 mp -90.25 -45.14 9.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.359 -179.21 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.09 -36.79 80.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.007 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.635 ' HE3' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.87 -36.03 73.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 179.785 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.582 ' N ' ' HG3' ' A' ' 104' ' ' MET . 11.7 mt -87.01 -10.47 53.05 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.186 0.517 . . . . 0.0 109.991 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -108.02 -3.46 18.72 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.157 -176.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.808 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -150.75 131.46 7.22 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.204 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.03 -2.02 8.04 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.931 2.42 . . . . 0.0 112.064 179.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.468 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -117.31 -28.52 6.12 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.343 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.808 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -62.63 -42.93 99.87 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.469 -178.887 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.635 ' HG ' ' HE3' ' A' ' 104' ' ' MET . 5.9 tt -61.25 -30.6 70.55 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.281 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.525 ' HG2' ' N ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -89.48 -63.52 1.27 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 0.0 110.5 180.0 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.525 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 2.7 m -49.41 -36.85 23.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.386 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.468 ' HD2' ' OE2' ' A' ' 100' ' ' GLU . 33.3 mmtt -80.1 -35.71 36.47 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.044 178.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.651 HG21 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -60.59 -50.23 81.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.561 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.457 ' HA ' HG23 ' A' ' 119' ' ' VAL . 30.1 t70 -55.82 -37.16 68.29 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.094 178.304 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -39.67 69.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.85 178.487 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.66 -25.97 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.663 HG22 ' CE1' ' A' ' 82' ' ' HIS . 17.0 t -59.68 -53.94 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.496 176.638 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.23 -26.37 28.3 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.918 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.517 ' O ' HG12 ' A' ' 121' ' ' VAL . 17.5 t -85.76 -31.03 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.918 179.575 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.574 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.95 -41.36 62.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 110.014 179.27 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.515 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 34.7 mm-40 -63.37 -34.3 77.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.879 178.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.437 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.678 177.734 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.666 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.679 0.276 . . . . 0.0 110.811 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.877 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -163.03 -177.19 5.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.771 179.442 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -50.08 -38.0 36.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.066 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.614 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 4.1 m -61.44 -45.14 95.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.489 179.333 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.666 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.46 -43.38 96.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.057 178.692 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.96 -46.2 88.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.619 179.345 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.34 -9.74 58.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.109 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.3 t -80.76 -8.29 59.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.798 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.076 179.77 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.965 0.412 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -120.0 38.4 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.564 179.199 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.434 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 65.2 tt0 -127.81 -56.07 1.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.361 -179.126 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.566 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.2 ptt? -74.91 1.18 13.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -178.816 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.659 HD21 HD11 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -65.09 -41.52 94.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.672 -179.457 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.696 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.04 26.67 3.39 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.563 -179.119 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -138.98 -4.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.994 0.426 . . . . 0.0 110.895 179.754 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.566 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 4.5 tpm_? -126.99 -24.41 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.987 179.864 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -74.9 -30.03 61.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.328 179.703 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.466 ' HD1' ' HA ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -40.04 -54.67 4.3 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.031 -178.089 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.8 Cg_endo -65.27 -26.28 56.59 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.934 1.756 . . . . 0.0 112.028 178.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.451 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 63.8 mt -81.57 -20.97 38.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.687 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 15.6 mm -69.53 -36.95 73.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.808 0.337 . . . . 0.0 110.112 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.646 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.2 mt-30 -53.41 -14.78 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 178.049 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.403 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -82.71 -40.42 20.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.698 178.702 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.687 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.25 -45.52 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.188 0.518 . . . . 0.0 110.142 179.26 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.658 ' ND1' HG13 ' A' ' 119' ' ' VAL . 9.3 m-70 -112.3 145.51 33.01 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.927 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.442 ' O ' ' HB ' ' A' ' 84' ' ' THR . 18.2 Cg_exo -30.97 -49.08 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.26 2.64 . . . . 0.0 112.456 -179.354 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.646 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 11.6 t 173.85 22.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.938 178.567 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -72.24 11.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.566 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.68 ' HB1' ' HB ' ' A' ' 78' ' ' ILE . . . -77.03 44.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.477 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -85.69 -10.7 75.77 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.332 177.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.594 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.5 tptt -175.11 31.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.245 179.414 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.67 HG21 HG13 ' A' ' 115' ' ' VAL . 62.1 mt -79.58 -89.35 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 120.806 -0.357 . . . . 0.0 110.561 179.119 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.696 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.54 -38.57 60.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 179.241 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.47 -31.91 57.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.993 178.01 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.802 ' HG2' HG22 ' A' ' 96' ' ' ILE . 38.4 ttp -83.37 -23.14 32.57 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.717 -0.241 . . . . 0.0 110.446 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.732 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.6 mm? -61.92 -6.18 2.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.497 178.68 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.654 HD22 HD12 ' A' ' 70' ' ' LEU . 2.0 mm? -108.99 20.84 17.96 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 176.476 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.643 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -162.52 1.72 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.473 -179.327 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.955 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.06 -152.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 121.35 0.595 . . . . 0.0 111.757 -179.9 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.4 t70 -59.43 -2.2 0.3 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.262 178.256 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.55 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.3 m-80 78.55 -31.16 0.15 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.53 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.3 m -73.1 -29.54 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.02 0.438 . . . . 0.0 109.924 178.353 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.955 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -78.28 -21.84 49.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.757 177.533 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 1.8 tp -75.25 -25.01 57.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.902 176.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.2 mp -90.63 -46.34 8.34 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.286 -179.127 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -37.78 88.74 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.116 -178.926 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.835 ' HE2' HD21 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -60.86 -36.67 79.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.55 -179.657 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.659 HD11 HD21 ' A' ' 70' ' ' LEU . 11.6 mt -87.38 -6.03 58.63 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 110.518 179.639 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 58.8 mm-40 -109.5 -13.48 14.56 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.642 -175.701 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -138.3 139.11 24.26 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -176.825 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 8.2 Cg_exo -74.24 19.55 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 112.366 179.571 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.1 OUTLIER -146.77 -26.14 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.99 -179.957 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 107' ' ' SER . 0.6 OUTLIER -62.92 -41.25 99.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.58 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.877 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.08 -28.1 1.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.964 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -96.24 -65.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.076 -179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 31.9 t -46.95 -29.28 1.96 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.374 . . . . 0.0 110.262 179.368 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 39.3 mmtt -80.69 -42.34 22.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.723 177.784 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.67 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -64.79 -60.07 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.154 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -49.34 -40.64 36.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.864 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.56 -33.87 64.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.908 0.385 . . . . 0.0 110.338 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.494 ' HB1' ' O ' ' A' ' 114' ' ' LYS . . . -68.14 -21.66 64.91 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.975 178.24 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.814 ' HA ' HD22 ' A' ' 122' ' ' LEU . 24.2 t -67.83 -46.15 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.738 176.813 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.45 -32.08 72.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.575 177.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 121' ' ' VAL . 12.2 t -79.41 -30.81 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.614 179.166 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.814 HD22 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -74.69 -42.02 59.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.29 179.904 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.18 -30.66 70.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.707 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.467 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.435 177.354 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.707 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.736 0.303 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.86 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -169.59 -178.72 3.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.144 178.329 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -51.3 -33.68 29.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.504 ' HB3' ' HE3' ' A' ' 57' ' ' MET . 0.4 OUTLIER -68.7 -47.97 65.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.793 -179.885 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.504 ' HE3' ' HB3' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.09 -37.82 75.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.491 0.662 . . . . 0.0 109.749 178.431 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.596 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 15.7 mt -66.08 -44.15 85.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.638 179.239 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.37 -9.67 35.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.562 178.803 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 57' ' ' MET . 40.1 m -78.94 -5.8 54.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.955 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.449 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.423 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.915 -179.291 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 2.3 mt-30 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.974 0.416 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.8 ptmt -134.67 27.88 3.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.734 179.314 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.608 ' N ' HD23 ' A' ' 70' ' ' LEU . 3.3 mm100 -135.09 -49.43 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.916 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.596 ' HE1' ' HA ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -80.77 3.2 23.14 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -176.863 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -75.38 -35.31 61.1 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.107 0.48 . . . . 0.0 109.862 179.375 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.855 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -129.1 26.99 4.36 Favored Glycine 0 N--CA 1.438 -1.219 0 C-N-CA 119.847 -1.168 . . . . 0.0 112.702 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -144.34 -1.25 0.94 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.763 0.316 . . . . 0.0 111.381 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.0 -22.09 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.313 0.578 . . . . 0.0 109.972 179.118 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.666 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -78.09 -23.82 47.8 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.499 178.649 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.419 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -36.74 -54.63 1.67 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.438 -178.176 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.419 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.4 Cg_endo -72.1 -22.05 23.13 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.034 1.823 . . . . 0.0 112.795 -179.334 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.707 HD13 ' HB2' ' A' ' 53' ' ' LEU . 94.3 mt -89.36 -19.06 25.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.888 -178.73 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.832 HG13 ' HB ' ' A' ' 90' ' ' THR . 9.8 mm -73.79 -40.11 53.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 178.086 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.494 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.0 OUTLIER -53.89 -17.09 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.858 177.351 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.49 -37.88 35.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.868 178.732 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.701 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.25 -47.14 52.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.485 179.973 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.807 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.0 m-70 -113.33 148.97 40.74 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.622 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -56.3 79.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.433 2.088 . . . . 0.0 111.981 179.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.494 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 58.4 p 45.57 34.42 1.67 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.154 -178.483 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -89.7 6.95 39.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.016 -179.73 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -80.1 46.92 0.85 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.272 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.52 85.7 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.562 -0.828 . . . . 0.0 111.583 178.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.621 ' HB3' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -174.3 29.07 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.92 0.39 . . . . 0.0 110.702 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.705 HG21 HG13 ' A' ' 115' ' ' VAL . 65.8 mt -80.43 -93.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.406 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.855 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -50.67 -40.77 54.54 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.444 -178.925 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.503 ' HA3' ' HZ1' ' A' ' 88' ' ' LYS . . . -55.08 -31.51 56.12 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.092 -1.051 . . . . 0.0 111.054 178.686 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.748 ' HG2' HG21 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -84.99 -22.75 28.98 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 120.846 0.355 . . . . 0.0 110.155 179.412 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 89' ' ' ILE . 4.4 mm? -61.89 -5.78 2.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.797 ' HA ' HD13 ' A' ' 101' ' ' LEU . 5.1 mp -108.51 26.7 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.166 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.563 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.3 pt-20 -165.93 -0.21 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.314 -179.267 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.935 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.04 -152.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.366 0.603 . . . . 0.0 111.517 -179.993 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.5 t70 -59.44 -3.84 0.5 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.307 177.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.602 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.9 m-20 77.61 -28.73 0.17 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.356 -179.576 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.424 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.3 m -74.03 -26.55 60.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 177.671 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.935 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.4 OUTLIER -81.33 -26.49 35.57 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.454 176.985 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.797 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -74.96 -25.26 58.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.403 176.242 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.459 ' HA ' HD22 ' A' ' 102' ' ' LEU . 1.0 OUTLIER -86.73 -48.43 8.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.214 -179.374 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.516 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -62.76 -42.32 99.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.091 -178.863 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.662 ' HE1' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.49 -33.63 66.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.303 -179.726 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.568 HD21 ' HG ' ' A' ' 70' ' ' LEU . 25.9 mt -86.76 -10.3 53.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.054 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.72 -8.92 15.29 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.735 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.732 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -140.72 133.38 14.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.846 -178.723 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.454 ' O ' HG21 ' A' ' 54' ' ' THR . 60.3 Cg_endo -71.4 3.71 3.41 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.595 2.196 . . . . 0.0 111.803 178.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -126.47 -11.09 6.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -79.06 -46.07 18.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.121 0.486 . . . . 0.0 109.704 177.989 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.86 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.54 -40.47 18.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.205 176.097 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.412 ' HG2' ' N ' ' A' ' 113' ' ' SER . 3.8 ttt180 -80.33 -57.33 3.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.375 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.412 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 42.1 t -53.71 -56.83 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.766 0.317 . . . . 0.0 110.799 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.52 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 7.6 mmtm -54.65 -32.81 59.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.705 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -72.11 -58.32 5.34 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.046 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.31 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.601 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.3 OUTLIER -54.77 -31.47 58.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.113 0.482 . . . . 0.0 110.29 178.552 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -79.95 -32.45 39.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.832 178.408 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.476 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -69.69 -20.81 63.55 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.746 177.468 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.687 HG13 ' ND1' ' A' ' 82' ' ' HIS . 21.5 t -69.48 -47.8 70.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.412 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.494 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -59.3 -25.58 64.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.471 177.03 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.407 ' O ' HG12 ' A' ' 121' ' ' VAL . 6.2 t -86.05 -34.96 8.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.098 178.692 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -67.23 -33.3 75.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.203 178.254 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.58 -27.34 37.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.615 176.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.494 ' HB1' ' O ' ' A' ' 120' ' ' ALA . . . . . . . . 0 CA--C 1.516 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.368 179.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.771 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.65 0.262 . . . . 0.0 110.976 . . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.837 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.98 -175.36 1.21 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.647 178.585 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.593 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -50.34 -45.77 55.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.591 -179.687 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.802 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 20.7 m -55.9 -45.45 78.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.8 0.333 . . . . 0.0 110.718 179.854 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.802 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -60.29 -42.91 96.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.377 178.964 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.593 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.68 -46.9 86.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.338 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.46 -9.48 53.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.026 179.65 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.439 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.2 t -82.22 -9.17 59.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.003 -179.615 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.419 179.878 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.717 0.294 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.575 ' CA ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -127.15 26.33 6.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.032 179.686 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -128.34 -53.28 1.28 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.429 ' HE1' ' O ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -78.58 20.5 0.43 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.155 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.575 HD23 ' CA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -89.65 -53.43 4.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.168 0.508 . . . . 0.0 110.385 179.698 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.931 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -108.32 18.66 32.85 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.379 -0.915 . . . . 0.0 111.775 178.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.78 -10.59 2.07 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.338 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.53 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.55 -15.38 5.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.571 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.787 HD13 HD13 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -78.13 -12.67 60.01 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.526 179.968 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.666 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.4 t80 -49.64 -54.55 30.13 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.768 -177.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.666 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 26.3 Cg_exo -63.27 -7.88 13.16 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.139 1.892 . . . . 0.0 112.329 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.771 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.1 mm? -98.63 -37.46 9.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.65 -179.178 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.736 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.5 mm -61.1 -42.46 93.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-O 120.717 0.294 . . . . 0.0 110.942 -179.626 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.779 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 7.3 mt-30 -48.88 -18.79 0.31 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.956 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.49 -40.14 18.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.255 179.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.624 ' HE2' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -72.53 -35.47 68.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.347 0.594 . . . . 0.0 110.601 179.674 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.62 ' ND1' HD12 ' A' ' 89' ' ' ILE . 7.2 m170 -121.61 157.44 56.75 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.649 -177.037 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.525 ' HD2' HD11 ' A' ' 85' ' ' LEU . 16.3 Cg_exo -67.29 69.08 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.488 2.126 . . . . 0.0 111.586 179.031 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.779 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.5 OUTLIER 52.41 24.2 2.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.753 -178.252 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.525 HD11 ' HD2' ' A' ' 83' ' ' PRO . 0.0 OUTLIER -76.93 1.97 16.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.168 -179.33 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.736 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.39 -135.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.76 -17.24 11.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.97 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.94 ' HE2' ' HB2' ' A' ' 122' ' ' LEU . 0.1 OUTLIER -155.88 -20.98 0.11 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.756 HD12 HG21 ' A' ' 119' ' ' VAL . 61.2 mt -50.17 -80.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 CA-C-N 117.706 0.23 . . . . 0.0 111.397 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.931 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.1 -40.22 67.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.557 0.217 . . . . 0.0 110.88 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.95 -28.77 61.22 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.581 176.836 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.628 ' O ' HG22 ' A' ' 96' ' ' ILE . 3.3 ttm -75.65 -37.0 60.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 121.474 0.654 . . . . 0.0 109.83 177.35 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.589 HD23 ' N ' ' A' ' 93' ' ' LEU . 4.5 mm? -56.06 -9.63 0.66 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.72 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.74 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.7 mp -105.24 27.09 8.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.363 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -170.19 1.26 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.758 -178.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.993 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.99 -148.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 121.436 0.636 . . . . 0.0 111.42 -179.768 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.601 ' N ' HG12 ' A' ' 96' ' ' ILE . 3.3 t70 -54.38 -9.82 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.799 175.929 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.69 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.6 m120 79.43 -24.1 0.22 Allowed 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.41 -0.813 . . . . 0.0 111.164 -179.696 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -75.51 -28.47 59.15 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.993 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.42 -33.91 63.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.007 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.74 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -65.3 -27.73 68.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.194 178.445 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.58 -48.33 9.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -39.06 90.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.501 -178.527 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.716 ' HE1' HD21 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -57.45 -37.49 72.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.37 -179.365 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.584 ' N ' ' HG3' ' A' ' 104' ' ' MET . 6.6 mt -87.5 -8.52 56.31 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.115 0.483 . . . . 0.0 110.293 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -106.47 -8.4 17.12 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.267 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.771 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.95 133.48 11.61 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.63 0.252 . . . . 0.0 111.557 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.29 3.44 2.54 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.692 2.261 . . . . 0.0 112.207 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.17 -26.0 3.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.23 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.771 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.76 -44.1 94.44 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.223 179.743 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.837 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.2 OUTLIER -47.43 -41.24 19.8 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.471 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.624 ' HA ' ' HE2' ' A' ' 81' ' ' MET . 1.6 ttt180 -79.09 -64.15 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 t -49.18 -54.07 18.2 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.717 0.294 . . . . 0.0 111.134 -178.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 5.4 mmtt -59.38 -28.95 67.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.091 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.586 ' O ' HG23 ' A' ' 119' ' ' VAL . 1.4 t -71.85 -58.41 5.17 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 178.142 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.639 ' HA ' HG22 ' A' ' 119' ' ' VAL . 3.8 t70 -51.24 -36.69 43.09 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.864 0.364 . . . . 0.0 110.869 178.089 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.74 -40.17 69.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.477 179.015 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.462 ' CB ' HD21 ' A' ' 93' ' ' LEU . . . -62.39 -29.82 70.76 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.931 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.756 HG21 HD12 ' A' ' 89' ' ' ILE . 22.4 t -55.49 -50.62 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-O 121.387 0.613 . . . . 0.0 109.822 177.387 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.51 -29.16 34.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.763 177.442 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 121' ' ' VAL . 12.3 t -84.6 -31.65 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.898 179.13 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.94 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.36 -43.17 74.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.958 179.503 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.485 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.3 mm-40 -65.37 -30.33 71.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.887 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.315 179.026 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.693 ' HB2' HD11 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.711 0.291 . . . . 0.0 111.121 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.85 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.42 -178.2 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.325 178.026 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -50.19 -38.39 39.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.645 -179.134 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.463 ' HB2' ' HE3' ' A' ' 57' ' ' MET . 1.0 OUTLIER -64.1 -48.91 74.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.843 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.467 ' H ' ' HE3' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.13 -40.23 80.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.296 0.569 . . . . 0.0 110.357 179.377 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.623 ' HA ' ' HE2' ' A' ' 69' ' ' MET . 13.3 mt -64.08 -45.0 90.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.98 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.82 -7.66 29.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.567 178.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 57' ' ' MET . 21.5 t -83.77 -5.23 59.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.768 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.353 -179.493 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.117 0.484 . . . . 0.0 110.297 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.92 40.21 3.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.407 179.3 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.567 ' N ' HD21 ' A' ' 70' ' ' LEU . 52.0 tt0 -138.01 -52.71 0.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.972 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.623 ' HE2' ' HA ' ' A' ' 58' ' ' LEU . 3.7 ptt? -81.7 6.52 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -176.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.05 -59.08 5.28 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.257 0.551 . . . . 0.0 110.2 -179.82 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.759 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -116.91 32.53 5.44 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.201 -1.0 . . . . 0.0 112.697 -179.183 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -141.09 -1.06 1.4 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.733 0.301 . . . . 0.0 111.27 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.509 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.26 -23.04 3.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.092 0.472 . . . . 0.0 110.057 179.343 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.656 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.5 -22.42 54.5 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.663 178.62 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.453 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -40.09 -55.26 4.02 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.241 -177.952 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 59.5 Cg_endo -72.4 -16.04 27.8 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.04 1.826 . . . . 0.0 112.596 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.693 HD11 ' HB2' ' A' ' 53' ' ' LEU . 50.6 mt -92.84 -21.1 20.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.603 -179.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.774 HG13 ' HB ' ' A' ' 90' ' ' THR . 10.3 mm -73.15 -38.94 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.713 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 0.2 OUTLIER -52.08 -17.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.04 177.724 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.38 41.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.864 178.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.69 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -71.42 -45.01 63.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.538 -179.96 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.789 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 5.4 m-70 -115.45 139.95 25.28 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.382 -179.979 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -50.5 82.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.53 2.154 . . . . 0.0 112.147 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.713 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 73.5 p 43.72 40.04 2.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.163 -178.837 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.789 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -97.17 6.28 48.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.183 -179.477 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.617 ' HB3' ' HB ' ' A' ' 78' ' ' ILE . . . -81.07 56.31 2.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.106 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.91 -8.56 75.83 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.151 177.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.618 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -177.65 31.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.394 179.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.722 HG21 HG11 ' A' ' 115' ' ' VAL . 80.9 mt -79.66 -89.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.981 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.774 ' HB ' HG13 ' A' ' 78' ' ' ILE . 0.5 OUTLIER -51.66 -42.46 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.448 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.47 -30.65 50.32 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.014 -1.089 . . . . 0.0 110.919 178.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.69 ' HG3' HG21 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -83.8 -23.58 31.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.452 -0.374 . . . . 0.0 110.199 178.941 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.63 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.2 mm? -60.72 -10.61 5.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.91 179.052 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.723 ' HA ' HD11 ' A' ' 101' ' ' LEU . 6.5 mp -105.68 27.17 8.7 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 176.755 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.609 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -166.03 -0.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.699 -178.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.983 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.44 -150.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.508 0.67 . . . . 0.0 111.727 -179.389 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.58 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -55.09 -8.43 0.28 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.851 175.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.757 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 80.08 -31.13 0.13 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.942 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.7 m -67.94 -29.17 68.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.834 178.44 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.983 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -76.08 -34.96 59.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.757 177.255 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.723 HD11 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -64.62 -30.15 71.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.913 178.263 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.67 -47.75 11.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.362 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -42.2 95.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.494 -178.132 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.711 ' HE2' HD21 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.17 -34.9 66.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.505 -179.123 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 12.8 mt -85.84 -11.04 54.39 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.937 -179.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.53 -4.83 15.99 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.781 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -143.56 133.52 11.92 Favored Pre-proline 0 C--N 1.331 -0.207 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.948 -179.245 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 12.8 Cg_exo -70.73 1.13 5.38 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.98 2.453 . . . . 0.0 111.946 179.316 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' A' ' 113' ' ' SER . 76.7 mt-10 -125.56 -11.48 6.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.537 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.781 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.04 -44.98 24.88 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.142 0.496 . . . . 0.0 109.733 177.908 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.85 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.77 -41.92 24.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.25 176.07 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.66 -61.14 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.551 -179.499 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.55 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.96 -53.23 20.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.809 0.338 . . . . 0.0 111.224 -178.895 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 71.4 mmtt -60.59 -29.74 69.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.018 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.722 HG11 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.81 -56.01 11.65 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.253 178.774 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.524 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -53.88 -35.36 61.49 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 110.512 178.761 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -38.88 63.29 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.28 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 93' ' ' LEU . . . -62.36 -22.56 66.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.749 HG13 ' ND1' ' A' ' 82' ' ' HIS . 19.1 t -68.37 -49.01 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-O 121.084 0.469 . . . . 0.0 109.831 177.022 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.46 -27.17 65.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.389 177.149 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.564 HG12 ' HE2' ' A' ' 92' ' ' MET . 8.5 t -83.88 -30.8 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.464 179.097 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.656 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -76.07 -33.52 59.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.824 178.804 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -67.54 -33.43 75.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.862 178.442 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.549 177.8 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.758 ' HB3' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.816 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.751 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -167.83 179.37 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.372 179.521 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -46.5 -44.51 17.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.664 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -46.64 82.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.729 179.921 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.483 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.09 -42.36 85.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.898 178.565 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -61.12 -42.23 98.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.417 178.583 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -17.29 48.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.507 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.9 t -69.7 -22.05 63.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.117 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.838 -179.874 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.428 ' O ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 120.946 0.403 . . . . 0.0 111.028 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -126.85 31.01 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 -179.607 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -132.46 -55.93 0.96 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.712 -179.523 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.722 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 2.8 ptt? -80.9 28.12 0.36 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.563 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -89.87 -47.38 7.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.24 0.543 . . . . 0.0 109.956 178.834 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.727 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -110.79 12.62 29.78 Favored Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 177.658 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -127.51 0.53 6.24 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.722 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.49 -31.56 2.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.787 -0.188 . . . . 0.0 111.325 -179.706 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.845 ' HB2' HG22 ' A' ' 90' ' ' THR . 2.9 mm? -57.62 -27.15 62.52 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.127 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.474 ' HB3' ' CD ' ' A' ' 76' ' ' PRO . 9.2 t80 -38.41 -62.12 0.75 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.003 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.614 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 30.0 Cg_endo -62.19 -14.81 40.29 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.897 1.731 . . . . 0.0 112.312 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.662 ' HG ' ' H ' ' A' ' 53' ' ' LEU . 2.1 mm? -96.73 -25.99 15.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.866 -178.685 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.663 HG12 ' O ' ' A' ' 74' ' ' LEU . 7.3 mm -70.88 -46.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 CA-C-O 120.845 0.355 . . . . 0.0 110.758 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.927 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 21.4 mt-30 -50.11 -19.22 0.7 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.543 178.876 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.61 -37.71 27.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.961 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -74.87 -37.27 62.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.757 -179.838 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.746 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -124.49 150.62 65.19 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.605 -179.526 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.453 ' O ' HD12 ' A' ' 85' ' ' LEU . 31.2 Cg_exo -58.27 79.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.438 2.092 . . . . 0.0 111.641 179.036 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.927 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 13.1 t 40.35 36.62 0.36 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.368 -178.3 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -86.13 2.63 45.99 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.072 -179.87 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -66.75 -141.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.409 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.66 -7.16 59.22 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.816 -179.132 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.582 ' HB3' HD11 ' A' ' 122' ' ' LEU . 0.8 OUTLIER -161.98 -25.24 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.748 -0.226 . . . . 0.0 111.527 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.668 HG21 HG12 ' A' ' 115' ' ' VAL . 61.8 mt -49.14 -81.97 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -178.39 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.845 HG22 ' HB2' ' A' ' 74' ' ' LEU . 0.3 OUTLIER -56.74 -37.21 70.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.821 -179.828 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.72 -28.33 56.69 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 177.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.61 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.1 ttp -77.23 -34.67 55.93 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.33 0.586 . . . . 0.0 109.797 177.17 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HG22 ' A' ' 96' ' ' ILE . 4.5 mm? -58.27 -9.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.591 -178.264 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.604 HD13 HD11 ' A' ' 101' ' ' LEU . 1.5 mm? -104.31 26.75 8.51 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.751 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -171.36 1.03 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.031 -178.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.987 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.66 -148.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.466 0.651 . . . . 0.0 111.696 -179.239 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.598 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.6 t0 -54.24 -9.67 0.3 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.863 176.167 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.668 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.7 m120 79.66 -22.07 0.3 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -78.29 -25.33 46.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.058 0.456 . . . . 0.0 109.791 177.407 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.987 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -78.72 -25.44 44.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.817 177.327 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.694 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.9 tp -74.66 -27.24 60.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.094 178.491 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.48 -45.67 9.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.829 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.452 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.7 t-80 -62.85 -47.03 85.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.166 -178.92 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.897 ' HE2' HD23 ' A' ' 111' ' ' LEU . 7.1 ptm -52.59 -35.71 54.74 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.536 -178.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.57 HD22 ' HB3' ' A' ' 70' ' ' LEU . 25.1 mt -83.57 -11.92 56.75 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.963 -178.695 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -108.33 -11.56 15.18 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.715 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.461 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.15 137.05 17.53 Favored Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.981 -178.941 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.458 ' O ' HG22 ' A' ' 54' ' ' THR . 6.5 Cg_exo -73.63 2.22 6.07 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.941 2.427 . . . . 0.0 111.923 179.433 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -121.42 -16.01 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.546 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.478 ' HG ' ' HA ' ' A' ' 104' ' ' MET . 3.3 p -74.66 -51.22 14.98 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.007 0.432 . . . . 0.0 109.859 178.612 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.897 HD23 ' HE2' ' A' ' 104' ' ' MET . 0.1 OUTLIER -46.78 -38.77 10.61 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.319 177.429 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.598 ' HA ' ' HE2' ' A' ' 81' ' ' MET . 16.1 ttt180 -81.05 -65.42 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.242 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 74.9 m -47.63 -54.5 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.785 0.326 . . . . 0.0 111.22 -178.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 118' ' ' ALA . 9.0 mmtt -58.89 -33.06 70.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.132 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.668 HG12 HG21 ' A' ' 89' ' ' ILE . 1.3 t -70.61 -55.03 15.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.625 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -52.06 -40.1 60.63 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.89 178.174 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -73.58 -34.9 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.24 178.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -66.6 -24.15 66.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.961 178.016 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.746 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -63.5 -51.46 70.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 176.61 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.6 -24.67 34.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.538 176.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 121' ' ' VAL . 34.7 t -84.63 -32.83 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.924 179.489 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.71 -44.23 62.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.023 179.294 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.533 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.0 mm-40 -63.73 -29.5 70.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.986 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.495 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.949 178.276 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.713 ' HB2' HD11 ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.847 0.356 . . . . 0.0 110.963 . . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.463 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.36 -167.16 0.77 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.106 178.658 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -55.75 -34.5 65.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.51 -178.894 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.506 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 75.2 m -65.0 -51.54 61.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.646 179.569 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.633 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.1 -38.23 76.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.278 179.219 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.655 HD22 HD21 ' A' ' 70' ' ' LEU . 13.2 mt -63.03 -44.64 95.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.575 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.0 -15.99 38.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.96 179.736 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 t -72.76 -5.95 41.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 179.562 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.59 ' HB1' ' HE3' ' A' ' 69' ' ' MET . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.088 179.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.407 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.946 0.403 . . . . 0.0 111.146 . . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HA ' HD22 ' A' ' 70' ' ' LEU . 1.8 mttt -136.62 11.16 3.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.291 178.915 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -120.39 -56.55 1.97 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.681 -179.193 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.59 ' HE3' ' HB1' ' A' ' 61' ' ' ALA . 42.8 mtm -60.82 -7.92 2.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -177.572 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.655 HD21 HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -64.73 -48.76 73.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.124 0.488 . . . . 0.0 110.204 -179.124 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.761 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -117.85 14.39 12.76 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.732 178.488 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -128.01 1.58 5.92 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.691 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.54 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.6 tpt180 -126.38 -34.6 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.244 -0.183 . . . . 0.0 110.897 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.761 ' HB2' HG23 ' A' ' 90' ' ' THR . 3.0 mm? -59.14 -35.25 73.17 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 178.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.476 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.0 t80 -35.19 -61.68 0.48 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -174.533 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.54 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 33.8 Cg_endo -63.87 -16.86 57.27 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.057 1.838 . . . . 0.0 112.528 -178.972 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.713 HD11 ' HB2' ' A' ' 53' ' ' LEU . 52.4 mt -98.53 -23.95 15.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.799 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 74' ' ' LEU . 1.6 mm -69.18 -35.78 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-O 120.97 0.414 . . . . 0.0 110.214 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.754 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.1 mt-30 -53.29 -17.32 1.71 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.26 -38.83 20.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.832 178.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.519 ' HE2' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -70.2 -44.85 67.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.126 0.489 . . . . 0.0 110.436 179.549 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.75 ' ND1' HG13 ' A' ' 119' ' ' VAL . 2.0 m-70 -115.75 155.03 48.09 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.227 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.49 ' O ' HD11 ' A' ' 85' ' ' LEU . 24.7 Cg_exo -63.23 75.56 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.47 2.113 . . . . 0.0 111.994 179.538 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.754 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 30.3 p 47.17 45.85 16.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.213 -179.318 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.506 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 2.4 mp -103.39 9.09 38.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.073 -179.636 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.637 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.39 20.95 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.973 -179.219 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.483 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -48.64 -27.35 6.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 178.805 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 92' ' ' MET . 5.0 ttpt -171.9 40.41 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.154 178.823 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.685 HG22 HG11 ' A' ' 115' ' ' VAL . 47.8 mt -79.84 -83.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.649 178.684 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.761 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.5 -35.9 63.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.418 179.01 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.02 -30.2 60.19 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.219 -1.153 . . . . 0.0 110.219 176.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.636 ' O ' HG23 ' A' ' 96' ' ' ILE . 3.2 ttp -75.14 -36.11 61.61 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.031 -0.585 . . . . 0.0 109.882 176.451 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.617 HD13 ' NZ ' ' A' ' 114' ' ' LYS . 4.6 mm? -59.9 -3.7 0.59 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.582 -177.656 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.718 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.0 mp -109.2 26.16 10.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 175.669 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -170.86 3.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.34 -178.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.815 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.4 -150.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 121.483 0.659 . . . . 0.0 111.619 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.6 t70 -59.58 -2.76 0.38 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.108 177.356 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.611 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.2 m120 77.99 -31.56 0.16 Allowed 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.208 -179.651 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.428 ' H ' ' C ' ' A' ' 97' ' ' ASP . 0.1 OUTLIER -68.51 -35.98 78.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.297 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.815 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.5 mt-10 -68.18 -43.91 77.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.367 177.388 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.718 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -54.76 -21.83 12.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.804 0.335 . . . . 0.0 110.711 177.316 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.406 HD11 ' O ' ' A' ' 98' ' ' ASN . 2.5 mp -92.92 -45.12 8.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.735 -179.197 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.444 ' HB3' ' HG ' ' A' ' 110' ' ' SER . 0.1 OUTLIER -70.24 -30.25 67.27 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.708 -177.839 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.765 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 0.5 OUTLIER -65.19 -34.51 78.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.632 0.253 . . . . 0.0 110.78 179.846 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.476 ' HA ' HD12 ' A' ' 58' ' ' LEU . 5.7 mt -87.13 -12.14 47.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.167 0.508 . . . . 0.0 110.052 178.266 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -105.69 -4.72 20.67 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.083 -176.16 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.874 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.2 t -149.03 133.14 8.76 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.555 -179.415 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.55 8.93 2.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.586 2.191 . . . . 0.0 112.358 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -133.89 -20.51 1.97 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.11 -179.882 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.874 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.2 OUTLIER -64.55 -53.31 49.98 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.208 0.528 . . . . 0.0 109.784 177.73 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.639 ' HG ' ' HE1' ' A' ' 104' ' ' MET . 10.0 tt -47.64 -35.36 9.25 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.175 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.519 ' HA ' ' HE2' ' A' ' 81' ' ' MET . 2.0 ttt-85 -86.63 -52.1 5.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -178.268 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.1 m -52.7 -50.13 63.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.663 -178.019 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.765 ' NZ ' ' HB3' ' A' ' 104' ' ' MET . 0.4 OUTLIER -80.4 -25.65 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.946 -178.533 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.685 HG11 HG22 ' A' ' 89' ' ' ILE . 1.1 t -59.9 -51.34 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.594 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.556 ' HA ' HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -58.23 -34.42 70.42 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.434 177.467 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -77.18 -27.34 53.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.719 178.331 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.621 ' O ' ' HE2' ' A' ' 92' ' ' MET . . . -71.98 -27.74 62.96 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.224 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.75 HG13 ' ND1' ' A' ' 82' ' ' HIS . 16.4 t -58.2 -51.35 72.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.752 176.01 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.53 -28.53 31.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.797 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 121' ' ' VAL . 5.1 t -85.52 -31.03 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.99 179.245 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.466 HD21 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -69.57 -41.75 75.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.9 179.094 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.441 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 82.4 mm-40 -72.49 -24.43 61.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.224 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.189 179.427 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.756 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 110.59 -0.152 . . . . 0.0 110.59 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.788 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -166.86 -176.35 3.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.144 0.497 . . . . 0.0 111.999 179.553 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.615 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -53.08 -56.91 12.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.393 -0.822 . . . . 0.0 112.686 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.2 m -47.37 -34.36 6.89 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.105 0.478 . . . . 0.0 110.97 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.655 ' SD ' ' HA ' ' A' ' 53' ' ' LEU . 4.3 mtt -75.35 -41.54 56.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.447 179.141 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.615 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.98 -38.09 69.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.822 176.859 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.22 -23.66 62.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.428 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -68.15 -7.39 29.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.29 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.259 -179.742 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.421 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.903 0.382 . . . . 0.0 110.86 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.515 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.4 28.99 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.966 -179.822 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.08 -52.02 0.84 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.194 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.464 ' HB2' ' CB ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -78.48 15.89 0.92 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -177.175 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.564 ' O ' HD13 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -89.43 -31.72 17.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.115 0.483 . . . . 0.0 110.591 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.812 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -132.36 10.39 5.31 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.552 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -127.92 -6.17 5.59 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.561 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -126.54 -16.51 5.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.935 0.397 . . . . 0.0 110.565 179.354 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.72 -16.75 58.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.059 178.964 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.717 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 13.8 t80 -49.34 -53.88 35.48 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.924 -177.543 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.717 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.1 Cg_exo -65.73 -6.45 14.0 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.149 1.9 . . . . 0.0 112.494 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.642 HD22 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.78 -38.68 8.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.635 -179.274 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.614 HD12 HG22 ' A' ' 115' ' ' VAL . 4.8 mm -60.0 -40.47 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.883 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.888 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 31.0 mt-30 -47.66 -21.45 0.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.796 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.11 -44.03 17.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.848 178.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.444 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -66.78 -43.14 84.75 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.302 0.572 . . . . 0.0 110.225 179.187 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.51 ' CE1' ' CG2' ' A' ' 119' ' ' VAL . 4.7 m170 -121.52 143.99 39.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.456 -177.729 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.53 80.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.563 2.175 . . . . 0.0 112.254 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.888 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 61.9 p 43.32 32.72 0.51 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.196 -179.115 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.491 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -88.34 6.93 34.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.09 -179.367 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.607 ' HB1' ' HB ' ' A' ' 78' ' ' ILE . . . -71.59 20.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.882 -179.422 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.491 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -54.26 -22.62 22.88 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.834 -179.933 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.615 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.0 OUTLIER -165.46 28.76 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.0 111.216 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.688 HG22 HG23 ' A' ' 119' ' ' VAL . 60.8 mt -80.42 -88.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.386 -0.525 . . . . 0.0 110.817 179.019 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.812 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.02 -41.5 59.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.279 -179.943 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.67 -31.13 57.48 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.068 -1.063 . . . . 0.0 111.055 178.497 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.652 ' O ' HG23 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -83.43 -23.29 32.37 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 178.685 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.654 ' HA ' HG22 ' A' ' 96' ' ' ILE . 4.4 mm? -61.63 -7.53 3.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.631 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.772 ' HA ' HD11 ' A' ' 101' ' ' LEU . 4.6 mp -106.66 26.26 10.2 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.571 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.7 pt-20 -167.08 1.87 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.33 -178.608 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.946 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -151.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 121.334 0.587 . . . . 0.0 111.697 -179.702 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.566 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 0.8 OUTLIER -59.04 -3.56 0.37 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.998 177.949 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.566 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 34.3 m-80 79.19 -28.65 0.15 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.524 179.536 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -31.22 60.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.09 0.471 . . . . 0.0 109.877 178.201 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.946 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -75.42 -23.32 56.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.937 177.863 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.772 HD11 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -75.1 -25.62 58.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.862 177.031 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mp -87.15 -49.38 7.33 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.984 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.482 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.3 t-80 -59.49 -46.97 87.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.709 -179.548 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.778 ' HE2' HD23 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -53.2 -36.51 61.05 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -178.169 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.557 ' N ' ' HG3' ' A' ' 104' ' ' MET . 6.9 mt -86.64 -5.5 59.11 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.342 0.592 . . . . 0.0 110.071 179.1 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -110.44 -8.09 14.71 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.001 -175.026 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.464 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.4 OUTLIER -146.25 142.0 17.09 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.061 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.64 ' HA ' HG22 ' A' ' 54' ' ' THR . 7.5 Cg_exo -73.2 -0.57 9.34 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 179.437 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -124.43 -19.38 5.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.568 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.531 ' HG ' ' H ' ' A' ' 111' ' ' LEU . 4.4 p -63.74 -50.53 68.71 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.233 0.54 . . . . 0.0 109.79 178.169 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -46.49 -29.24 1.67 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.118 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.457 HH21 ' HG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -92.59 -63.42 1.23 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.985 -179.858 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.544 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 43.5 m -49.31 -30.21 7.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.958 179.15 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.489 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.0 mmtm -80.84 -41.22 23.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.844 178.093 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.614 HG22 HD12 ' A' ' 78' ' ' ILE . 2.0 t -66.43 -62.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.124 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.614 ' HA ' HG22 ' A' ' 119' ' ' VAL . 5.3 t0 -48.67 -36.13 15.37 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.644 0.259 . . . . 0.0 111.258 178.608 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 113' ' ' SER . 7.4 mt-10 -74.05 -41.14 62.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.818 0.342 . . . . 0.0 110.514 179.114 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.44 -21.77 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.691 178.057 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.688 HG23 HG22 ' A' ' 89' ' ' ILE . 59.1 t -66.79 -46.43 85.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.866 177.412 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.16 -26.57 66.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.506 176.652 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.441 ' O ' HG11 ' A' ' 121' ' ' VAL . 11.2 t -85.32 -32.08 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.579 179.057 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.595 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.79 -35.77 70.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.825 179.004 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -71.97 -28.52 63.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.114 178.33 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.235 179.234 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.799 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.845 0.355 . . . . 0.0 110.95 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -163.62 -171.95 2.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.489 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -53.73 -36.88 62.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.192 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.523 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.2 m -60.95 -46.01 92.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.799 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.66 -43.22 89.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.056 178.325 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -57.77 -48.23 80.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.572 178.973 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.37 -3.21 19.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.367 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 t -87.23 -6.77 58.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.074 -179.787 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.283 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.675 -179.954 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.953 0.406 . . . . 0.0 110.648 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HA ' HD22 ' A' ' 70' ' ' LEU . 5.4 ptpt -116.18 40.65 2.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.888 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.609 ' N ' HD12 ' A' ' 70' ' ' LEU . 10.0 mt-30 -139.23 -54.54 0.58 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.721 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.59 ' SD ' HD22 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -81.08 3.07 24.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.849 -178.889 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.747 HD11 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -69.97 -39.33 76.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 0.0 111.085 179.765 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.84 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -135.34 24.96 3.34 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.236 -0.983 . . . . 0.0 112.87 -179.504 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -138.09 -5.42 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.564 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.28 -20.85 4.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.873 -179.825 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.689 ' HG ' HD21 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -74.83 -13.09 60.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.692 -178.748 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.712 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 8.4 t80 -48.32 -56.71 13.06 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.703 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.712 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 24.5 Cg_exo -63.29 -11.7 26.77 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.042 1.828 . . . . 0.0 112.046 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -94.79 -28.35 15.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.462 -179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.756 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -67.78 -39.64 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.013 -179.608 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.858 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -50.47 -20.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 110.125 178.682 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.75 -40.87 24.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.449 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.756 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.44 -50.75 28.7 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.184 0.516 . . . . 0.0 110.52 -179.62 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.776 ' ND1' HG12 ' A' ' 119' ' ' VAL . 2.0 m-70 -111.49 151.61 43.39 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.491 -179.673 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.418 ' O ' HD23 ' A' ' 85' ' ' LEU . 18.8 Cg_endo -59.53 81.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.387 2.058 . . . . 0.0 111.798 179.555 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.858 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.0 t 42.13 31.0 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.532 -178.776 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.62 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -80.45 2.22 26.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.585 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -66.01 -144.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.971 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.72 -15.62 50.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.69 -179.114 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.79 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.1 tptt -156.46 -22.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.642 HD13 HG21 ' A' ' 119' ' ' VAL . 68.4 mt -49.25 -86.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -177.491 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.84 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.97 -41.83 64.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.276 -178.599 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.461 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.27 -31.45 50.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.217 178.463 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.79 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.79 -25.06 30.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.885 0.374 . . . . 0.0 110.323 179.185 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.579 HD22 ' O ' ' A' ' 89' ' ' ILE . 4.1 mm? -59.08 -10.86 2.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.417 178.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.696 HD11 HD21 ' A' ' 101' ' ' LEU . 3.8 mp -101.89 25.97 8.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.728 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.531 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -169.1 1.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.154 -177.614 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.991 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.42 -148.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.41 0.624 . . . . 0.0 111.408 -179.417 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.589 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.2 t70 -54.33 -9.42 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.824 176.081 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.701 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 79.88 -23.1 0.25 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.138 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -32.74 58.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.408 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.991 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -69.65 -34.64 74.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.049 177.545 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.696 HD21 HD11 ' A' ' 94' ' ' LEU . 2.3 tm? -65.9 -28.73 69.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.274 178.741 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.15 -49.85 9.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.911 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.474 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 1.5 t-80 -58.79 -48.44 81.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.958 -178.888 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.689 ' HE2' HD23 ' A' ' 111' ' ' LEU . 0.9 OUTLIER -52.29 -35.5 50.56 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.157 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.734 HD22 HD23 ' A' ' 70' ' ' LEU . 17.5 mt -84.8 -8.78 58.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 0.0 110.791 -179.404 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.474 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.06 -7.33 16.14 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.615 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.409 ' CB ' ' HG ' ' A' ' 110' ' ' SER . 0.5 OUTLIER -143.13 140.15 17.53 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 120.506 -0.477 . . . . 0.0 112.042 -179.169 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.473 ' O ' HG23 ' A' ' 54' ' ' THR . 60.1 Cg_endo -72.18 3.8 3.77 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.645 2.23 . . . . 0.0 111.991 179.07 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -128.72 -19.01 3.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.416 ' HB3' ' ND1' ' A' ' 103' ' ' HIS . 4.9 p -64.22 -49.86 70.29 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.356 0.598 . . . . 0.0 109.675 177.447 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.95 -26.78 1.07 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.783 178.05 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.432 ' HG2' ' HE1' ' A' ' 81' ' ' MET . 54.0 mtp180 -95.94 -65.69 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.78 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 5.0 m -46.12 -30.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.296 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.757 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 69.4 mmtt -80.44 -42.44 22.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.697 177.819 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.551 HG21 ' HG ' ' A' ' 93' ' ' LEU . 2.2 t -66.06 -60.37 2.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.874 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.535 ' HA ' HG22 ' A' ' 119' ' ' VAL . 5.3 t70 -48.0 -38.9 18.14 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.31 178.679 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.476 ' HB2' ' O ' ' A' ' 113' ' ' SER . 1.9 mt-10 -76.87 -33.27 57.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.271 179.466 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.616 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -67.55 -26.79 66.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.882 177.958 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.776 HG12 ' ND1' ' A' ' 82' ' ' HIS . 20.0 t -61.52 -51.14 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.05 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.58 32.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.779 177.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.487 ' O ' HG13 ' A' ' 121' ' ' VAL . 14.3 t -85.52 -31.35 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.945 179.546 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.563 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.53 -41.31 63.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.026 179.363 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 2.2 mm-40 -61.69 -37.96 86.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 178.822 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.352 177.072 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.714 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.78 0.324 . . . . 0.0 110.736 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.862 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.11 -176.44 2.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.294 179.099 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -52.23 -25.06 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 111.269 -179.488 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.451 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 40.6 m -74.23 -49.13 24.65 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.741 179.562 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.714 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.11 -39.45 78.69 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.376 0.608 . . . . 0.0 109.997 178.776 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.463 ' CD1' ' HA ' ' A' ' 55' ' ' ALA . 8.3 mt -64.1 -45.04 90.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.418 179.102 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.79 -7.85 18.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.844 179.066 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.4 t -84.05 -7.3 59.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.616 179.317 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.457 ' HB3' ' HE1' ' A' ' 69' ' ' MET . . . . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.319 179.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.051 0.453 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.85 36.72 2.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.473 178.471 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.526 ' C ' HD13 ' A' ' 70' ' ' LEU . 1.3 tp-100 -127.6 -52.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.468 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 14.4 mtm -76.03 -6.17 49.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.659 -179.378 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -63.2 -32.45 73.85 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.172 -179.421 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.778 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -148.74 27.48 1.31 Allowed Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.822 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 3.3 mt-10 -142.29 0.39 1.33 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.891 0.377 . . . . 0.0 111.173 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.551 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -136.12 -20.84 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.169 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.699 HD13 HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -73.48 -22.7 60.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.353 178.283 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.54 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -39.82 -56.04 3.34 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.355 -177.906 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.551 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 11.6 Cg_exo -73.1 -15.74 25.69 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.326 2.017 . . . . 0.0 112.784 -179.255 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.686 HD11 ' HB2' ' A' ' 53' ' ' LEU . 37.1 mt -91.23 -32.01 15.93 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.624 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.596 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.5 mm -65.19 -37.13 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.089 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.745 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.0 mt-30 -48.92 -16.16 0.12 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.495 177.14 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -84.27 -44.58 13.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.675 178.186 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.617 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 1.2 mtm -67.67 -27.81 67.16 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.563 0.697 . . . . 0.0 110.18 178.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.7 ' HE2' HG12 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -114.29 164.2 16.97 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.739 -177.257 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.474 ' HD2' ' CG ' ' A' ' 82' ' ' HIS . 74.0 Cg_endo -77.11 47.68 2.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.134 1.889 . . . . 0.0 111.368 177.021 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.745 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 66.45 51.05 1.2 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.796 -178.487 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.44 ' HB3' ' CD2' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -118.94 0.81 11.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.719 179.789 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.554 ' CB ' ' HB ' ' A' ' 78' ' ' ILE . . . -73.46 58.63 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.179 179.455 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -98.24 -0.7 58.3 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.886 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.5 ttpt -156.74 -15.79 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.023 -0.588 . . . . 0.0 111.908 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.585 HG12 HD23 ' A' ' 122' ' ' LEU . 48.5 mt -51.18 -84.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -176.812 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.778 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -51.46 -38.37 53.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.02 -177.851 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.95 -29.87 68.77 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.99 -1.1 . . . . 0.0 110.367 176.262 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.886 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.4 ttm -75.56 -37.75 59.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.042 176.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.545 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 4.6 mm? -55.61 -8.34 0.37 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.48 -178.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.631 HD11 ' HA3' ' A' ' 71' ' ' GLY . 4.9 mp -106.26 27.94 8.2 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.688 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -171.98 3.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.462 -178.252 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.938 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.22 -151.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.318 0.58 . . . . 0.0 111.496 -179.86 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.8 t0 -59.53 -3.54 0.48 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.237 178.253 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.574 ' H ' HG12 ' A' ' 96' ' ' ILE . 27.4 m120 77.82 -27.23 0.17 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.425 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.415 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.3 m -77.75 -23.35 49.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 177.785 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.938 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.92 -25.87 29.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.676 177.512 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.52 HD13 HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -74.99 -24.75 58.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.393 0.615 . . . . 0.0 109.385 176.134 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -86.73 -48.6 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.074 -0.967 . . . . 0.0 111.158 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.415 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.04 -37.28 83.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.194 -178.695 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.747 ' HE1' HD21 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -57.56 -36.82 72.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.136 -179.85 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 6.9 mt -87.11 -9.77 54.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.211 0.529 . . . . 0.0 110.047 178.445 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.415 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 62.8 mm-40 -108.44 -1.98 19.4 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.28 -176.144 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.818 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -150.32 135.95 10.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.764 -179.462 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.417 ' O ' HG22 ' A' ' 54' ' ' THR . 72.5 Cg_endo -74.04 3.98 4.63 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.566 2.177 . . . . 0.0 112.04 179.025 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 113' ' ' SER . 7.7 mt-10 -128.0 -11.41 5.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.607 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.818 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.83 -44.68 22.48 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.606 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.862 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.28 -40.82 17.67 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.95 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.617 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 2.4 ttt180 -81.16 -64.39 1.2 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.28 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.562 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.01 -51.13 25.24 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 -178.702 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.795 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 30.9 mmtt -61.01 -30.18 70.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.845 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.583 HG13 ' CG2' ' A' ' 89' ' ' ILE . 1.4 t -72.83 -55.0 14.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.981 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.617 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 0.5 OUTLIER -56.9 -28.65 62.2 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.227 0.537 . . . . 0.0 109.927 177.314 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -80.02 -33.93 38.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.383 177.223 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.449 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -68.67 -17.87 64.17 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.514 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.7 HG12 ' HE2' ' A' ' 82' ' ' HIS . 37.1 t -66.77 -52.79 41.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.412 175.864 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.06 -27.49 61.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.968 177.389 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 121' ' ' VAL . 15.2 t -85.94 -31.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.691 179.123 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.614 ' HA ' ' HZ3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.14 -29.35 61.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.348 -179.733 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -83.2 -23.59 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.786 177.28 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.054 179.32 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.34 -63.31 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.603 2.202 . . . . 0.0 112.166 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 mt -89.95 -173.13 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.71 56.97 0.67 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.575 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.6 t -104.12 -61.53 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.731 0.301 . . . . 0.0 110.929 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -109.87 -172.18 1.99 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.042 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.34 102.84 2.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -139.75 -25.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 55.37 72.63 0.47 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.159 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.83 117.91 5.09 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.975 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.34 -4.94 15.95 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.451 2.101 . . . . 0.0 112.341 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.16 74.63 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.005 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.4 t -89.7 23.55 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.1 ttt85 -97.6 -52.49 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 p -97.4 163.7 12.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.004 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 11.2 m -88.72 147.62 39.75 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.071 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.75 147.49 40.48 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.58 2.186 . . . . 0.0 112.387 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -74.29 84.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.862 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -73.78 -14.77 61.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 mptt -96.7 88.32 4.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -78.15 92.83 4.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.23 104.02 9.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.251 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.1 135.86 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.958 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -92.11 48.32 2.69 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.583 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 t -90.67 -20.39 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.971 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.6 mtt180 -79.11 171.92 14.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -85.86 113.43 51.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.869 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.97 88.73 1.06 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.452 2.101 . . . . 0.0 112.397 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -78.9 -174.37 3.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.8 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -98.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.826 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.7 m170 51.59 31.14 7.3 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.879 0.371 . . . . 0.0 111.138 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.55 41.7 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.995 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -101.73 8.93 41.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -91.9 71.16 5.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.079 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.539 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 1.0 OUTLIER -96.16 -51.49 0.23 Allowed Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.361 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 25.4 Cg_exo -63.59 -174.0 0.2 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.321 2.014 . . . . 0.0 112.185 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.17 128.56 33.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.813 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 p -86.24 124.28 40.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.023 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.9 t -106.64 -0.99 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.866 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.53 ' O ' ' HG2' ' A' ' 42' ' ' GLN . 0.8 OUTLIER -89.63 177.54 6.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 62.42 20.67 12.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.06 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.53 ' HG2' ' O ' ' A' ' 40' ' ' MET . 7.5 pt20 -156.9 96.2 2.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.948 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.25 171.64 1.68 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.614 2.209 . . . . 0.0 112.224 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -84.72 57.17 4.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.944 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -104.81 93.15 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.146 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -84.25 179.44 7.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 p -96.63 98.92 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.1 0.476 . . . . 0.0 110.991 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -98.37 -31.76 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.871 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.81 -165.11 34.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.556 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -99.07 -178.51 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.692 0.282 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.481 ' H ' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -63.79 129.27 93.7 Favored Pre-proline 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.038 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.46 179.03 6.81 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.465 2.11 . . . . 0.0 112.415 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.654 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER -92.79 138.61 31.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.838 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.625 ' HA ' HD23 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -173.98 -163.76 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.514 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.563 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -58.29 -43.8 88.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.506 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.77 ' HB2' ' HE3' ' A' ' 57' ' ' MET . 31.9 m -56.56 -45.39 81.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.844 0.354 . . . . 0.0 110.487 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.77 ' HE3' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -61.43 -40.43 94.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.861 ' HG ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -60.98 -45.38 95.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -9.1 52.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.08 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.0 t -82.41 -8.73 59.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.603 ' HB2' ' H ' ' A' ' 65' ' ' GLU . . . -133.73 57.7 27.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.169 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.658 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 52.7 Cg_exo -54.6 -51.53 10.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.392 2.062 . . . . 0.0 113.127 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 61.7 Cg_endo -94.37 15.69 1.18 Allowed 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.424 2.083 . . . . 0.0 112.5 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.405 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . 1.9 mt-30 -124.7 -98.84 0.42 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.559 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.727 ' HB2' ' HG3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.07 47.39 0.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.492 -178.075 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.658 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -68.24 -24.73 64.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.053 0.454 . . . . 0.0 110.772 179.23 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.649 ' HA ' HD21 ' A' ' 70' ' ' LEU . 4.7 mmtt -124.79 35.17 4.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.577 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.7 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 5.9 tt0 -130.42 -61.97 0.94 Allowed 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.727 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 35.9 mtm -58.82 -9.38 1.76 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.861 HD23 ' HG ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -70.12 -28.31 65.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.961 0.41 . . . . 0.0 110.81 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.882 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -146.52 9.92 1.45 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.442 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.28 -9.62 6.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.516 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.16 -12.73 5.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.909 0.385 . . . . 0.0 110.531 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.63 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.59 -17.1 58.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.928 -179.313 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.693 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.7 t80 -47.12 -54.57 19.93 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 22.1 Cg_exo -65.37 -9.25 21.48 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.134 1.889 . . . . 0.0 112.249 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.654 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.3 mm? -96.3 -39.06 9.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.794 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.601 HG23 HD13 ' A' ' 89' ' ' ILE . 4.0 mm -60.34 -41.61 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.859 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.647 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.4 mt-30 -48.53 -20.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.627 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.72 -43.67 16.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.856 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.606 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -67.78 -40.85 83.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.5 179.604 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.65 ' ND1' HD12 ' A' ' 89' ' ' ILE . 4.9 m170 -123.18 144.1 42.65 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.55 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.459 ' O ' HD11 ' A' ' 85' ' ' LEU . 41.2 Cg_exo -55.75 81.57 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.478 2.119 . . . . 0.0 111.715 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.647 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 9.4 t 41.42 30.3 0.13 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.276 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.459 HD11 ' O ' ' A' ' 83' ' ' PRO . 1.2 mp -80.56 0.4 34.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.075 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.54 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -66.67 -138.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.621 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.88 -8.56 49.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.856 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.564 ' HE2' ' SD ' ' A' ' 92' ' ' MET . 1.2 tptt -161.3 -25.6 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.738 -0.231 . . . . 0.0 111.501 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.784 HG22 HG21 ' A' ' 119' ' ' VAL . 61.0 mt -49.2 -80.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.882 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.63 -38.51 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.684 -0.235 . . . . 0.0 110.937 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.79 -28.7 57.55 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.661 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.1 ttp -77.39 -34.34 54.9 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.199 0.523 . . . . 0.0 109.827 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.678 ' HG ' HG22 ' A' ' 115' ' ' VAL . 4.5 mm? -58.76 -7.97 1.17 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.691 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.636 HD11 ' HA3' ' A' ' 71' ' ' GLY . 4.4 mp -107.84 27.83 8.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -171.59 3.24 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.521 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.946 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.332 0.587 . . . . 0.0 111.85 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.42 -2.46 0.32 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.361 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 9.6 m-20 78.27 -30.12 0.16 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.42 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.412 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.5 m -72.87 -31.88 65.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.074 0.464 . . . . 0.0 109.83 178.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.946 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.9 OUTLIER -76.37 -23.3 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.775 177.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -75.27 -23.75 57.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.049 177.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.07 -45.67 8.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.3 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -39.6 92.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.056 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.695 ' HE1' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -59.98 -33.13 71.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.491 -179.56 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.747 HD23 HD13 ' A' ' 70' ' ' LEU . 17.3 mt -85.37 -12.35 52.37 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.742 0.306 . . . . 0.0 110.946 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -8.62 17.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.76 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -142.89 132.54 11.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.87 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 13.8 Cg_exo -69.88 1.62 4.35 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.893 2.395 . . . . 0.0 111.913 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -120.37 -26.56 5.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.272 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.76 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.93 -45.24 90.13 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.695 ' HG ' ' HE1' ' A' ' 104' ' ' MET . 4.7 tt -57.19 -26.28 60.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.062 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.606 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 1.9 ttt180 -88.28 -46.58 9.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.256 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 t -69.3 -33.53 73.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.874 0.369 . . . . 0.0 110.713 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.662 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 6.8 mmtt -78.85 -27.81 44.2 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.185 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.678 HG22 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -72.39 -55.88 11.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.298 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.648 ' HA ' HG23 ' A' ' 119' ' ' VAL . 20.2 t0 -52.91 -39.01 62.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 177.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -39.66 75.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.423 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.81 -22.07 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.043 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.784 HG21 HG22 ' A' ' 89' ' ' ILE . 56.1 t -65.3 -44.77 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.938 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.14 -25.93 65.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.505 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 121' ' ' VAL . 10.2 t -86.92 -31.39 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.857 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.59 HD23 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -71.98 -40.53 68.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.992 179.178 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 128' ' ' LYS . 81.1 mm-40 -68.48 -32.01 71.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.159 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.465 ' HA ' ' HG3' ' A' ' 128' ' ' LYS . . . -78.71 -10.99 59.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.923 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 1.6 t60 -117.52 -0.1 11.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.105 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -81.69 -95.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.413 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.24 21.88 7.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.698 0.285 . . . . 0.0 111.767 -178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.465 ' HG3' ' HA ' ' A' ' 124' ' ' ALA . 12.6 mttt -88.47 -154.41 0.28 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 111.081 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.48 -0.67 56.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.151 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.523 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -87.4 20.66 2.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.064 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.16 124.59 20.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.069 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -87.93 138.45 31.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.9 -26.67 21.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.57 109.04 4.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.4 ' H ' HG22 ' A' ' 135' ' ' VAL . 14.0 m -104.04 -0.78 10.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.087 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -90.0 -14.25 34.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.893 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 84.6 p -84.32 -5.82 59.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.857 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.22 -174.74 5.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 16.9 p -93.52 154.61 17.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.937 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -100.5 -84.9 1.83 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.48 106.75 34.82 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.461 0.172 . . . . 0.0 111.126 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.44 125.52 19.41 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.636 2.224 . . . . 0.0 112.351 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 55.7 p -83.83 172.6 12.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.821 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.0 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 CA-C-O 119.993 -0.337 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -72.29 -45.74 0.43 Allowed 'Cis proline' 0 C--N 1.347 0.479 0 C-N-CA 123.765 -1.348 . . . . 0.0 112.414 0.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.86 140.35 30.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.024 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.27 90.58 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.615 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.8 t -93.26 52.55 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.351 . . . . 0.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.57 158.0 0.09 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.271 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -165.15 25.55 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.129 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 59.22 -92.49 0.04 OUTLIER 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.141 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.423 ' HB2' ' H ' ' A' ' 10' ' ' THR . . . -117.27 -95.24 0.48 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.03 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' ALA . 1.0 OUTLIER -170.41 79.59 0.59 Allowed Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.02 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -82.07 39.5 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.652 2.235 . . . . 0.0 112.348 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.48 96.97 8.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.16 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.76 85.49 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -70.58 136.76 49.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.957 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.79 126.22 35.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -109.37 136.44 20.2 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.37 121.15 8.38 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.475 2.116 . . . . 0.0 112.262 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -79.54 93.81 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.81 119.13 12.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.922 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.89 41.39 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -88.57 16.84 6.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.862 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.67 -169.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.001 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.18 53.92 2.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.999 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.0 67.91 3.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.483 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -12.11 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.791 0.329 . . . . 0.0 111.043 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -15.87 49.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.905 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -97.07 139.9 21.77 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.75 153.84 97.42 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.762 -1.349 . . . . 0.0 112.25 0.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -93.54 -79.19 0.41 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.997 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.17 109.14 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.015 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -101.22 9.89 41.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.766 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.3 tt -97.69 -74.56 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.41 53.85 0.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.08 -168.07 0.58 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.017 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -106.23 96.27 13.07 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.953 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.35 -9.8 25.94 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.431 2.087 . . . . 0.0 112.343 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -96.48 91.24 5.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.019 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.5 m -88.45 2.12 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.1 24.14 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.846 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.08 -169.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.004 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -75.59 -158.79 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.858 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -121.52 80.63 38.79 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.071 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -69.87 86.42 0.6 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.426 2.084 . . . . 0.0 112.177 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -86.34 43.17 1.04 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.196 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.8 m -90.73 4.4 6.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.097 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -98.07 15.78 23.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.024 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 13.7 p -95.09 144.94 8.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.113 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -83.3 156.81 22.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.808 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -80.52 103.37 2.18 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.781 -0.724 . . . . 0.0 112.463 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -106.51 92.41 4.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -86.06 114.93 59.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.96 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.72 166.84 17.15 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.561 2.174 . . . . 0.0 112.524 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.704 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -91.22 150.12 21.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.67 179.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.517 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.58 -167.44 0.78 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.433 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.538 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -52.57 -43.97 65.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.852 -178.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.419 ' HB2' ' HE3' ' A' ' 57' ' ' MET . 0.8 OUTLIER -57.72 -51.23 70.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.874 0.369 . . . . 0.0 110.747 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.495 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.19 -38.59 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.248 179.166 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.528 HD23 HD21 ' A' ' 70' ' ' LEU . 16.0 mt -63.96 -42.89 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.064 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.18 -15.59 60.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.058 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 57' ' ' MET . 69.6 m -73.86 -6.98 50.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.884 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.64 ' HB2' ' HB3' ' A' ' 64' ' ' GLN . . . -133.24 61.85 57.4 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.039 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.623 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 45.1 Cg_exo -56.03 -53.07 5.98 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.577 2.185 . . . . 0.0 113.248 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.4 Cg_endo -98.27 24.03 0.24 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.529 2.153 . . . . 0.0 112.674 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.64 ' HB3' ' HB2' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -129.35 -94.88 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.75 -178.659 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.673 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.21 37.07 2.47 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -177.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.49 -23.61 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.918 0.39 . . . . 0.0 110.825 179.336 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.551 ' CA ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -129.75 28.65 5.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.841 179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.442 ' HG3' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -132.37 -54.98 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.965 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.673 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -75.52 18.1 0.25 Allowed 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -177.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.776 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.42 -32.58 17.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.239 0.542 . . . . 0.0 110.445 179.619 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.899 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -134.15 11.6 4.74 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.037 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.442 ' HG2' ' HG3' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -129.26 -8.54 4.75 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.145 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.554 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -127.34 -14.17 5.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.774 0.321 . . . . 0.0 110.969 179.852 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.617 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -77.31 -10.99 59.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.7 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 11.5 t80 -49.01 -55.41 20.78 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.68 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.7 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.6 Cg_exo -62.34 -9.73 16.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.087 1.858 . . . . 0.0 112.157 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.704 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.5 mm? -98.81 -28.21 13.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.579 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.743 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.8 mm -70.6 -40.47 77.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.732 0.301 . . . . 0.0 111.244 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.75 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.7 mt-30 -52.62 -19.3 2.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.351 0.596 . . . . 0.0 110.103 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.26 -38.88 30.04 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.959 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.743 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.2 -48.63 33.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.24 0.543 . . . . 0.0 110.167 179.413 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.5 m-70 -111.97 146.18 34.26 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.467 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.624 ' HD2' HD12 ' A' ' 85' ' ' LEU . 36.6 Cg_exo -57.18 78.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.544 2.163 . . . . 0.0 112.014 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.75 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 48.17 37.17 7.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.062 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.3 OUTLIER -92.48 4.99 52.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -179.351 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.695 ' HB3' ' HB ' ' A' ' 78' ' ' ILE . . . -69.88 -138.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.948 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.85 -10.14 53.38 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.793 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.629 ' HB3' HD11 ' A' ' 122' ' ' LEU . 1.1 tptt -159.96 -23.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.694 -0.253 . . . . 0.0 111.536 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.687 HG21 HG23 ' A' ' 119' ' ' VAL . 69.2 mt -49.68 -81.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.899 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -55.95 -37.72 69.39 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.636 0.255 . . . . 0.0 110.672 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.42 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.63 -28.45 59.93 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.218 -0.991 . . . . 0.0 110.648 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.612 ' O ' HG22 ' A' ' 96' ' ' ILE . 2.8 ttp -76.91 -33.99 57.74 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.352 0.596 . . . . 0.0 109.718 177.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.717 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.5 mm? -60.23 -4.61 0.85 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.829 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.61 HD11 ' HA3' ' A' ' 71' ' ' GLY . 3.4 mp -110.04 25.88 11.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 176.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -168.04 1.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.358 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.21 -153.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.439 0.638 . . . . 0.0 111.955 -179.531 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.403 ' H ' ' HB ' ' A' ' 96' ' ' ILE . 12.6 t0 -59.82 -2.62 0.41 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.302 178.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.582 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.49 -36.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.163 -179.466 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 3.0 m -65.28 -27.35 68.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.847 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.904 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -82.99 -25.62 32.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.587 177.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.673 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 2.3 tp -75.14 -25.33 58.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.701 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.75 -48.02 7.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.323 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.447 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -65.27 -37.01 85.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.429 -178.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.673 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 8.2 ptm -60.09 -38.17 82.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.797 0.332 . . . . 0.0 111.083 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.776 HD21 HD13 ' A' ' 70' ' ' LEU . 40.2 mt -81.64 -11.43 59.1 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.953 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.48 -9.11 14.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.857 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.825 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -140.77 126.95 11.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.661 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 17.1 Cg_exo -68.07 6.72 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.876 2.384 . . . . 0.0 112.314 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.43 ' H ' ' C ' ' A' ' 107' ' ' SER . 2.1 tt0 -127.8 -26.43 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.825 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.1 -46.78 85.72 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.642 HD13 ' HE3' ' A' ' 104' ' ' MET . 4.7 tt -49.99 -23.71 2.18 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.779 178.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 112' ' ' ARG . 15.1 mtp180 -92.96 -62.96 1.28 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.2 t -50.05 -29.54 9.03 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.126 0.489 . . . . 0.0 109.791 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.649 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -81.0 -42.98 20.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.666 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.717 HG23 ' HG ' ' A' ' 93' ' ' LEU . 1.2 t -63.97 -58.15 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.636 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.8 OUTLIER -50.98 -42.72 60.36 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.734 0.302 . . . . 0.0 110.868 178.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 113' ' ' SER . 4.4 mt-10 -70.31 -32.46 70.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.327 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 114' ' ' LYS . . . -69.01 -24.74 64.25 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.113 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.744 ' HA ' HD21 ' A' ' 122' ' ' LEU . 21.8 t -63.38 -46.11 96.27 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 CA-C-O 121.291 0.567 . . . . 0.0 109.664 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.44 -26.27 63.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.742 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 121' ' ' VAL . 7.9 t -86.98 -32.63 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.741 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.744 HD21 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -69.61 -38.29 77.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.93 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.435 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 14.6 mm100 -74.16 -27.0 60.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.962 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.695 ' HA ' ' HG2' ' A' ' 128' ' ' LYS . . . -83.54 -2.4 55.91 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.073 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -121.59 -26.14 4.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.044 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -83.75 -38.54 21.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.019 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.679 ' HB3' ' HD2' ' A' ' 128' ' ' LYS . . . -95.5 -62.85 1.23 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.758 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.695 ' HG2' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -98.14 169.06 9.87 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.852 0.834 . . . . 0.0 111.282 179.23 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.11 22.47 3.73 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.575 173.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.03 -37.66 72.05 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.586 -175.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.81 101.13 8.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.006 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -91.17 164.88 13.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -10.45 59.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.882 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -76.78 126.68 31.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.12 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 17.6 m -95.31 15.27 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.165 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -79.9 -40.13 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.948 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.81 -7.55 54.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.963 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -79.65 74.35 6.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.032 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 15.2 p -115.78 -173.82 2.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -86.9 -71.18 1.3 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.549 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 9.9 m -94.94 147.4 33.01 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.592 0.234 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -64.87 140.31 66.22 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.439 2.093 . . . . 0.0 112.294 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.566 HG22 ' H ' ' A' ' 144' ' ' VAL . 0.0 OUTLIER -104.67 -63.65 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.014 -179.814 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . 0.566 ' H ' HG22 ' A' ' 143' ' ' THR . 3.9 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.154 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 112.551 -0.22 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.62 175.62 6.88 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.465 2.11 . . . . 0.0 112.381 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 mp -80.65 -9.36 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -99.44 127.0 9.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.509 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.47 173.21 7.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.856 0.36 . . . . 0.0 110.907 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.28 -0.73 29.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.133 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.31 20.87 16.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.969 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.79 -28.19 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -137.42 91.21 2.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.091 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.14 118.88 59.37 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.52 4.02 4.85 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.606 2.204 . . . . 0.0 112.455 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.57 67.0 9.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.138 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.3 t -77.73 -31.73 17.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.951 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -77.46 174.76 10.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.75 55.89 3.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.2 100.99 49.17 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.59 -176.43 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.494 2.129 . . . . 0.0 112.275 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -165.91 0.59 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.96 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.39 145.75 55.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' HG2' ' HB1' ' A' ' 22' ' ' ALA . 1.5 tttt -98.01 108.49 21.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.926 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -0.82 33.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.512 ' HB1' ' HG2' ' A' ' 20' ' ' LYS . . . -67.91 139.12 56.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.027 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.52 -29.15 24.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.068 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.19 88.5 0.73 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 13.7 p -95.82 -28.58 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.887 0.375 . . . . 0.0 110.988 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -88.9 104.09 16.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.53 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 2.1 m-20 -86.94 -51.07 0.44 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.579 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 27' ' ' ASN . 38.2 Cg_endo -66.03 103.63 0.64 Allowed 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.037 1.825 . . . . 0.0 112.236 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -177.15 3.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -79.13 -26.23 42.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 57.32 26.94 13.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.061 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 tp -95.48 119.51 34.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -105.01 81.13 1.7 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.87 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.14 177.32 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -93.66 128.58 41.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.997 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.59 92.42 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.536 2.157 . . . . 0.0 112.352 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.09 108.67 19.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.0 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.419 HG22 ' N ' ' A' ' 39' ' ' THR . 7.9 p -91.05 140.9 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.938 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.419 ' N ' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -109.35 74.1 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.04 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -30.6 22.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.842 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.55 83.3 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.08 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -80.56 110.14 15.79 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.68 175.08 11.75 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.0 112.5 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.8 173.92 12.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.936 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.5 m -76.4 -172.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.039 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.58 82.42 2.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.4 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 1.7 m -111.31 56.11 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.027 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -74.45 -34.02 63.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.802 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.55 -76.0 1.25 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.373 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -84.69 75.2 10.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.853 0.359 . . . . 0.0 110.733 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.548 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 6.3 mt-10 -70.04 -51.49 14.37 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.446 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 85.7 Cg_endo -82.99 125.63 4.18 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.257 1.971 . . . . 0.0 112.706 -179.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.701 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -83.39 151.55 25.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.535 179.12 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.583 ' HA ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -170.21 -159.37 0.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.751 179.501 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -60.69 -37.31 81.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.313 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.607 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 6.3 m -59.8 -46.46 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.349 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.666 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.92 -40.65 94.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.191 178.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.489 ' CD2' ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.31 -47.19 84.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.561 179.214 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.94 -12.68 61.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.217 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.429 ' HB3' ' O ' ' A' ' 57' ' ' MET . 46.3 t -76.39 -7.36 54.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.598 ' HB2' ' HB3' ' A' ' 64' ' ' GLN . . . -134.4 60.49 43.65 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.185 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.57 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.8 Cg_exo -55.05 -51.29 10.6 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.534 2.156 . . . . 0.0 113.284 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.57 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 79.3 Cg_endo -89.04 -23.42 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.245 1.963 . . . . 0.0 112.622 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.598 ' HB3' ' HB2' ' A' ' 61' ' ' ALA . 43.3 tt0 -78.68 -91.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.843 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -95.24 -90.08 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.916 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 73.53 -40.92 0.48 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.379 0.425 . . . . 0.0 110.937 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.446 ' O ' HD12 ' A' ' 70' ' ' LEU . 2.8 mtpt -124.83 18.16 8.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.358 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.843 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -114.75 -43.57 3.13 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.396 -179.469 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.463 ' HG3' ' CB ' ' A' ' 65' ' ' GLU . 30.4 mtm -77.22 -9.63 58.91 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.67 HD22 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -58.49 -39.61 80.49 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.874 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -144.65 28.71 1.89 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.817 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -138.47 -9.32 1.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.583 0.23 . . . . 0.0 111.308 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.408 ' HD3' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -127.06 -14.84 5.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.783 0.325 . . . . 0.0 111.007 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.651 HD12 HD23 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.01 -25.19 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.855 -179.614 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.48 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.0 t80 -42.75 -55.69 6.94 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.169 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 19.3 Cg_endo -59.7 -18.23 46.97 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.976 1.784 . . . . 0.0 112.386 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.701 HD13 ' HB2' ' A' ' 53' ' ' LEU . 84.8 mt -99.09 -22.15 15.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.991 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.623 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.9 mm -65.46 -37.87 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.895 0.379 . . . . 0.0 110.431 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.476 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.4 mt-30 -53.93 -18.11 3.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.78 -34.57 30.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.08 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.472 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -79.35 -40.78 29.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.067 -178.326 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.677 ' ND1' HG12 ' A' ' 119' ' ' VAL . 1.4 m-70 -118.12 159.68 42.17 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.234 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.71 75.17 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.31 2.007 . . . . 0.0 111.796 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.476 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 43.8 p 45.73 36.09 2.54 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.982 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -87.23 1.84 51.92 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.045 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.567 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -65.72 -143.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.095 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.31 -11.66 60.39 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.301 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.896 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.1 ttpt -160.47 -21.96 0.06 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.697 HG23 HG11 ' A' ' 115' ' ' VAL . 64.0 mt -49.03 -80.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.874 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.6 -39.22 67.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.575 0.226 . . . . 0.0 110.768 -179.37 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.66 -27.54 64.04 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.896 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.8 ttm -76.46 -36.42 57.92 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.516 0.674 . . . . 0.0 109.561 177.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.749 ' HG ' HG22 ' A' ' 115' ' ' VAL . 4.4 mm? -57.71 -6.83 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.432 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.65 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.14 27.39 9.33 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.6 pt-20 -170.84 2.57 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.091 -0.958 . . . . 0.0 111.357 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.34 -150.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.456 0.646 . . . . 0.0 111.77 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.567 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 8.1 t0 -59.09 -3.97 0.44 Allowed 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.043 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.567 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 8.5 m120 78.79 -26.48 0.17 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.483 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.39 -32.12 60.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.103 0.477 . . . . 0.0 109.865 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.2 mt-10 -74.79 -24.85 58.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.837 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.633 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.7 tp -75.02 -24.66 58.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.958 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.9 mp -90.47 -47.03 7.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.122 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -37.12 85.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.352 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.633 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 6.0 ptm -60.07 -39.07 84.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.742 0.306 . . . . 0.0 110.793 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.67 HD21 HD22 ' A' ' 70' ' ' LEU . 59.8 mt -78.33 -13.13 59.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.541 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -109.41 -5.13 15.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.037 -177.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.815 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.7 t -147.31 139.69 14.21 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.228 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.491 ' HA ' ' HB ' ' A' ' 54' ' ' THR . 85.8 Cg_endo -80.05 2.92 8.05 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.981 2.454 . . . . 0.0 112.009 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -122.87 -18.96 6.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.306 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.815 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -72.24 -50.62 25.96 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.651 HD23 HD12 ' A' ' 74' ' ' LEU . 6.1 tt -50.09 -34.19 21.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.112 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -85.69 -60.04 2.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.228 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.5 m -53.63 -35.86 61.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.866 0.365 . . . . 0.0 111.027 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.63 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.2 mmtt -78.73 -28.59 44.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.557 179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.749 HG22 ' HG ' ' A' ' 93' ' ' LEU . 1.0 OUTLIER -71.07 -50.63 40.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.388 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.595 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -59.3 -38.82 81.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.432 177.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.1 -33.32 67.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.595 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.495 ' HB2' ' HE2' ' A' ' 92' ' ' MET . . . -65.43 -30.11 70.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.656 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.694 HG21 HD11 ' A' ' 89' ' ' ILE . 21.8 t -56.61 -53.38 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.699 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.33 -25.68 16.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.348 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.469 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 5.1 t -86.81 -32.55 6.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.422 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.827 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.28 -39.36 74.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.086 179.077 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.475 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -73.13 -26.91 61.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.659 178.049 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.61 1.73 54.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.504 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.519 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -124.5 -27.24 3.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.934 0.397 . . . . 0.0 110.63 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.576 ' HG3' HD11 ' A' ' 122' ' ' LEU . 58.9 mm-40 -89.41 -76.53 0.41 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.701 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -82.74 8.48 12.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.291 -177.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.789 ' HG3' ' HB1' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -69.76 -149.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.005 0.431 . . . . 0.0 110.574 179.082 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.477 ' C ' ' H ' ' A' ' 131' ' ' ALA . 0.2 OUTLIER -85.91 25.07 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.789 ' HB1' ' HG3' ' A' ' 128' ' ' LYS . . . -72.54 19.53 0.08 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.822 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.477 ' H ' ' C ' ' A' ' 129' ' ' GLU . . . -84.98 37.42 0.66 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.886 0.374 . . . . 0.0 111.34 -179.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -79.81 -79.09 0.15 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.971 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -63.75 1.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.8 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.47 117.9 12.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.047 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.3 t -94.23 -51.26 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.048 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -72.66 103.92 3.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.1 51.24 0.95 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 118.67 10.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.103 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.05 178.1 6.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.824 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -88.71 122.67 6.47 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.611 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.542 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 2.6 t -83.78 -51.26 0.63 Allowed Pre-proline 0 C--N 1.329 -0.3 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.542 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 48.3 Cg_exo -56.33 150.37 50.47 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.251 1.967 . . . . 0.0 112.408 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.8 p -102.92 -39.83 6.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.898 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.192 -179.816 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.24 -10.42 25.72 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.569 2.18 . . . . 0.0 112.332 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -70.31 0.7 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.69 111.27 3.91 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.501 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.7 t -86.53 142.09 28.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.11 143.44 32.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.156 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.19 63.04 1.83 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -158.47 153.27 24.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.115 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -114.94 118.21 32.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.044 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.534 ' HB ' ' HD3' ' A' ' 11' ' ' PRO . 3.3 m -63.49 -49.9 75.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.488 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.534 ' HD3' ' HB ' ' A' ' 10' ' ' THR . 52.5 Cg_exo -55.17 125.05 17.87 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.101 1.868 . . . . 0.0 112.219 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.48 34.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.211 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.98 92.11 3.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.043 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.82 156.47 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.15 151.19 23.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.89 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 p -103.24 114.73 64.84 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.838 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.45 96.42 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.497 2.131 . . . . 0.0 112.495 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -91.33 97.05 10.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.738 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -76.36 0.29 20.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.012 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -81.6 73.7 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.822 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -82.36 109.56 16.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.56 133.72 43.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.051 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -173.55 1.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.59 84.15 0.99 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.474 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 13.5 m -101.57 176.28 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.767 0.318 . . . . 0.0 111.102 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.45 123.49 33.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 m-20 -95.93 145.58 29.81 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.986 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.13 -70.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.605 2.203 . . . . 0.0 112.348 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -88.78 109.15 19.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -99.34 -81.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.049 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 -3.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.4 mt -94.44 100.18 12.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -102.47 102.38 12.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 86.27 1.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.084 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -103.41 147.33 34.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -83.08 162.63 73.35 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.478 -1.468 . . . . 0.0 112.393 0.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.56 -172.01 3.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.878 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.85 110.49 14.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.82 130.2 45.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.865 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.443 ' HG3' ' H ' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -84.48 168.37 15.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.92 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.443 ' H ' ' HG3' ' A' ' 40' ' ' MET . 4.5 pt20 -83.78 127.12 33.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.926 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.72 95.15 30.02 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.865 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -67.86 107.91 1.59 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.545 2.163 . . . . 0.0 112.256 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.1 61.18 6.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.4 m -90.17 30.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.107 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -91.4 -74.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 t -102.32 154.61 5.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.023 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -91.0 -2.44 57.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.808 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.52 -150.35 25.24 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.426 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -87.92 129.26 35.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.555 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 1.6 mm-40 -84.69 -50.96 0.57 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.558 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 31.6 Cg_endo -63.47 112.06 1.65 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.204 1.936 . . . . 0.0 112.53 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.757 ' H ' HD21 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -72.03 135.09 46.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.823 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.851 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.14 -176.18 1.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.042 178.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.575 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -49.48 -43.7 45.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.839 -179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.875 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 50.4 m -60.36 -48.14 83.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.026 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.875 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.22 -42.06 85.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.294 0.569 . . . . 0.0 110.472 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.641 HD12 HD21 ' A' ' 105' ' ' LEU . 9.5 mt -62.38 -45.17 94.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.19 -15.22 44.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.966 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 t -76.08 -6.32 50.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.558 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -132.69 59.84 46.0 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.104 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.627 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.9 Cg_exo -55.23 -52.65 7.33 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.449 2.099 . . . . 0.0 113.122 -179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.627 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.6 Cg_endo -97.97 27.51 0.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.528 2.152 . . . . 0.0 112.81 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.714 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 10.4 tt0 -136.04 -92.56 0.27 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.746 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.01 36.36 2.7 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.038 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.542 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -68.06 -20.74 64.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 110.609 178.711 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.527 ' CA ' HD21 ' A' ' 70' ' ' LEU . 9.4 pttt -131.43 26.89 4.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.895 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -131.02 -56.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.746 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -77.98 18.35 0.5 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.527 HD21 ' CA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.1 -32.76 17.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.31 0.576 . . . . 0.0 110.138 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.861 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -131.33 12.6 5.48 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.739 178.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -128.66 -3.42 5.34 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.491 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.99 -19.79 4.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.83 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.637 ' HB3' HD13 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -77.29 -22.17 52.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.107 -178.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.642 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.8 t80 -44.55 -55.17 10.78 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.102 -177.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 31.5 Cg_exo -60.4 -15.71 37.28 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.166 1.911 . . . . 0.0 112.711 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.757 HD21 ' H ' ' A' ' 53' ' ' LEU . 0.1 OUTLIER -98.65 -28.41 13.55 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.341 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.637 HD13 ' HB3' ' A' ' 74' ' ' LEU . 6.8 mm -61.66 -40.52 86.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.577 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.84 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 19.0 mt-30 -52.31 -17.43 1.15 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.914 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.22 -35.65 23.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.079 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -75.9 -37.62 58.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.925 -179.345 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.752 ' ND1' HG12 ' A' ' 119' ' ' VAL . 1.8 m-70 -121.22 162.64 34.62 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.502 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.408 ' HD2' HD11 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.46 71.67 0.64 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.298 1.998 . . . . 0.0 111.86 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.84 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.4 p 49.11 32.35 4.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.119 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.462 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 27.4 mt -84.71 5.91 26.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.22 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.602 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -67.53 -141.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.898 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.31 -10.67 34.49 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.456 -0.878 . . . . 0.0 111.608 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.817 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.1 OUTLIER -156.3 -25.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 179.791 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.645 HG23 HG12 ' A' ' 115' ' ' VAL . 56.6 mt -49.26 -85.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-O 120.629 0.252 . . . . 0.0 111.558 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.861 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.98 -40.0 66.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.0 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.59 -30.02 58.55 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.168 -1.015 . . . . 0.0 111.029 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.817 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.77 -25.62 32.61 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.624 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.3 mm? -60.77 -8.08 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.677 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.581 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.9 mm? -105.79 25.84 10.35 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 3.9 pt-20 -167.3 1.58 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.547 -178.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.886 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.0 -152.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.448 0.642 . . . . 0.0 111.963 -179.137 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.5 t70 -59.08 -2.95 0.3 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.272 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.559 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 12.7 m-80 78.14 -28.78 0.16 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.28 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.42 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.5 m -72.59 -31.03 64.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.132 0.491 . . . . 0.0 109.839 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.886 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.8 OUTLIER -78.17 -22.29 48.9 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.633 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.649 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.4 tp -75.14 -24.74 58.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.782 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.6 mp -91.15 -47.3 7.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.221 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -37.18 86.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.59 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.932 ' HE3' HD21 ' A' ' 111' ' ' LEU . 8.3 ptm -59.53 -38.74 81.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.572 0.225 . . . . 0.0 111.033 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.641 HD21 HD12 ' A' ' 58' ' ' LEU . 4.0 mt -86.62 -7.71 58.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.11 0.481 . . . . 0.0 110.093 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -108.99 -5.8 15.92 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.771 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.707 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.3 t -146.05 130.95 8.98 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 111.447 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 8.6 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.552 2.168 . . . . 0.0 112.076 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.418 ' H ' ' C ' ' A' ' 107' ' ' SER . 1.7 tt0 -128.67 -27.51 2.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.308 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.707 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -63.95 -44.57 92.4 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.054 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.932 HD21 ' HE3' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.15 -42.23 13.63 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 175.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.618 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 2.3 ttt180 -79.68 -64.91 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.522 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 33.3 t -48.65 -52.63 22.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.788 0.328 . . . . 0.0 111.328 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.619 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 10.5 mmtm -60.21 -30.96 69.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.05 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.645 HG12 HG23 ' A' ' 89' ' ' ILE . 1.2 t -71.19 -53.76 20.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.55 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -53.47 -36.91 62.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.031 0.443 . . . . 0.0 110.491 177.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.81 -33.96 60.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.985 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 114' ' ' LYS . . . -67.12 -24.37 65.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.043 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.752 HG12 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -65.49 -49.2 79.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.68 176.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.83 -27.49 60.2 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.6 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 121' ' ' VAL . 6.5 t -84.43 -30.28 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.691 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.16 -37.99 61.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.157 179.122 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -75.28 -20.25 59.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.028 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.48 -15.69 34.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.636 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.482 ' HA ' ' HB3' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -113.21 -50.9 2.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.187 -178.413 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.542 ' HB2' ' O ' ' A' ' 122' ' ' LEU . 46.2 mm-40 -57.23 -67.9 0.28 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -94.22 53.63 1.76 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.482 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . 3.9 pttt -64.18 118.01 7.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.626 -175.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.19 8.47 13.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.225 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -85.5 20.5 2.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.005 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.1 -2.06 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.021 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -74.0 -62.53 1.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 74.13 10.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.66 -49.17 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.068 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.0 m -94.31 167.76 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.215 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -79.27 -11.9 59.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.915 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.2 p -94.71 140.21 30.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.917 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.93 167.18 19.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.067 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 27.8 p -109.46 139.77 44.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -91.84 145.19 17.58 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.526 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 29.5 t -99.22 122.88 50.68 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.489 0.185 . . . . 0.0 111.027 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.55 125.33 13.69 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.508 2.139 . . . . 0.0 112.234 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 28.3 m -76.83 -29.52 55.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.957 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.084 -179.923 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 CA-C-O 120.156 -0.247 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -78.82 -164.3 3.91 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 123.394 -1.502 . . . . 0.0 112.35 0.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 85.28 5.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.845 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.88 -165.49 37.49 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.634 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.94 -175.36 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.781 0.324 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.61 103.84 5.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.122 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -84.54 166.04 17.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.078 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.03 127.65 15.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.218 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 55.93 88.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.288 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 2.7 t -133.5 124.77 18.25 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.938 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 10' ' ' THR . 26.6 Cg_exo -63.12 87.26 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.591 2.194 . . . . 0.0 112.318 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.56 0.15 38.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.993 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.5 m -101.58 125.69 55.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.043 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 mtm-85 -95.59 104.0 15.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.008 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.74 88.5 2.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.924 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -104.28 143.42 26.64 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -74.54 163.1 91.21 Favored 'Cis proline' 0 C--N 1.349 0.56 0 C-N-CA 123.676 -1.385 . . . . 0.0 112.14 0.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -85.49 -178.97 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.844 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -66.1 173.54 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.491 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -100.27 12.49 36.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.778 179.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -93.59 108.61 20.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.969 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.13 -75.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.37 53.07 2.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.14 -1.26 48.13 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.555 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -104.71 108.75 25.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.937 0.398 . . . . 0.0 110.981 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.518 ' HG3' ' H ' ' A' ' 27' ' ' ASN . 0.9 OUTLIER -85.84 180.0 6.93 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.987 -179.732 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.518 ' H ' ' HG3' ' A' ' 26' ' ' ARG . 89.6 m-20 -88.87 154.54 50.08 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.781 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -82.82 175.26 39.42 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.515 -1.452 . . . . 0.0 112.429 0.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.12 -163.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.84 167.85 16.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.774 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -123.48 68.63 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.928 0.394 . . . . 0.0 111.027 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mp -80.46 161.01 25.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.858 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -91.46 42.16 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.994 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.54 -5.52 55.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.94 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.6 116.86 59.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.935 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.01 -26.41 31.14 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.585 2.19 . . . . 0.0 112.205 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.82 46.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.058 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.42 ' O ' HG13 ' A' ' 38' ' ' VAL . 3.5 p -82.24 122.37 36.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.27 77.66 1.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.1 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.5 ptt? -95.22 -14.05 24.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -154.13 146.25 23.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.738 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.99 110.93 3.08 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.179 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.81 90.89 0.82 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.578 2.185 . . . . 0.0 112.181 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.37 127.23 32.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.207 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.401 HG22 ' N ' ' A' ' 46' ' ' HIS . 14.6 p -89.67 144.38 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.854 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.401 ' N ' HG22 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -80.08 -79.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -179.772 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.2 p -86.23 145.02 8.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.08 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 171.64 7.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.424 ' O ' HD13 ' A' ' 77' ' ' LEU . . . -99.97 70.0 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.672 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.0 87.47 4.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.804 0.335 . . . . 0.0 110.809 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.695 ' N ' ' HA ' ' A' ' 52' ' ' PRO . 3.8 mm-40 -90.84 -48.46 0.36 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.964 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.695 ' HA ' ' N ' ' A' ' 51' ' ' GLU . 67.4 Cg_endo -89.93 -173.71 7.3 Favored 'Cis proline' 0 C--N 1.356 0.953 0 C-N-CA 124.657 -0.976 . . . . 0.0 112.772 1.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.827 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -69.29 145.05 53.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.269 -179.502 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.628 HG21 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.46 -158.82 0.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.279 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.541 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -60.62 -40.64 92.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.447 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.3 m -58.27 -46.15 86.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.398 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.827 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.45 -43.33 93.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.12 178.558 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.541 ' CD2' ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.93 -48.74 75.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.487 178.992 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.29 -9.69 49.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.665 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.7 m -84.73 -8.38 58.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.217 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.531 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -135.14 56.43 16.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.553 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.557 ' HB3' ' HG3' ' A' ' 66' ' ' GLN . 92.2 Cg_endo -96.99 127.55 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.909 2.406 . . . . 0.0 112.845 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.448 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 74.5 Cg_endo -98.7 21.24 24.35 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.248 -1.147 . . . . 0.0 112.318 -0.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.79 -84.84 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.566 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.509 ' H ' ' HB2' ' A' ' 61' ' ' ALA . 1.7 mm-40 -104.21 20.6 18.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.852 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.557 ' HG3' ' HB3' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -57.42 -32.17 66.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.001 179.864 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.94 29.21 4.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.216 -179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.472 ' N ' HD13 ' A' ' 70' ' ' LEU . 4.0 mt-30 -127.37 -48.1 1.44 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.525 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -81.03 13.76 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.179 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.687 HD11 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -81.55 -40.35 23.24 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 120.906 0.384 . . . . 0.0 110.121 179.328 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.964 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -129.8 36.13 2.41 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.84 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 1.4 pt-20 -150.85 -11.85 0.23 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.436 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.92 -15.29 5.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 110.687 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.633 ' HA ' HD21 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.92 -12.43 59.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.31 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.466 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 9.1 t80 -48.19 -54.91 21.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.818 -177.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.48 ' HG2' HD22 ' A' ' 77' ' ' LEU . 36.7 Cg_endo -65.03 -8.08 17.2 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.114 1.876 . . . . 0.0 112.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.633 HD21 ' HA ' ' A' ' 74' ' ' LEU . 1.6 mm? -98.54 -28.19 13.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.267 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.77 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.7 mm -69.13 -40.38 80.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.322 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.916 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.9 mt-30 -51.19 -18.3 0.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.281 0.562 . . . . 0.0 110.355 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.35 -39.98 22.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.211 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.77 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.74 -44.35 61.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.091 0.472 . . . . 0.0 110.742 -179.596 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.724 ' ND1' HG12 ' A' ' 119' ' ' VAL . 1.7 m-70 -115.51 155.76 46.84 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.642 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.436 ' HD2' HD11 ' A' ' 85' ' ' LEU . 24.4 Cg_exo -62.92 76.18 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.508 2.139 . . . . 0.0 111.736 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.916 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.5 p 46.84 33.7 2.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.133 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 17.9 mt -87.18 6.41 33.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.211 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.619 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -69.6 -137.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.961 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.486 ' H ' ' HB3' ' A' ' 86' ' ' ALA . . . 82.1 -15.86 25.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.769 -178.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.89 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.0 ttpt -156.62 -21.6 0.1 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.688 HG22 HG13 ' A' ' 115' ' ' VAL . 62.0 mt -49.54 -81.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.964 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.26 -39.3 66.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.455 0.169 . . . . 0.0 110.795 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.07 -28.03 63.3 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.093 -1.051 . . . . 0.0 110.573 176.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.89 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.7 ttm -76.32 -36.87 58.07 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.521 0.677 . . . . 0.0 109.793 177.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.633 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.5 mm? -56.98 -6.32 0.34 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.561 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.632 HD22 ' HA3' ' A' ' 71' ' ' GLY . 2.3 mm? -108.75 27.7 9.17 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -170.1 1.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.195 -178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.924 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.16 -153.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 121.4 0.619 . . . . 0.0 111.616 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 99' ' ' SER . 7.6 t0 -59.34 -3.14 0.37 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.139 178.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.567 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.9 -35.14 0.17 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.264 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.415 ' H ' ' C ' ' A' ' 97' ' ' ASP . 2.1 m -67.32 -25.77 66.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.833 178.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.924 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.56 -24.67 31.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.858 177.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.49 HD22 ' O ' ' A' ' 93' ' ' LEU . 2.3 tm? -74.95 -27.19 60.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.54 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.7 mp -86.69 -46.83 9.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.36 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -37.93 85.06 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.201 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.697 ' HE3' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.86 -36.09 74.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.157 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.634 HD21 ' HG ' ' A' ' 70' ' ' LEU . 16.3 mt -86.92 -9.92 54.53 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.136 0.493 . . . . 0.0 110.1 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -107.5 -6.44 17.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.258 -176.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.825 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -148.71 130.33 7.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.636 0.255 . . . . 0.0 111.518 -179.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.57 -0.53 6.08 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.926 2.417 . . . . 0.0 112.465 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -123.69 -13.66 7.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.535 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.825 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -71.94 -46.04 58.96 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.016 0.436 . . . . 0.0 110.202 178.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.697 ' HG ' ' HE3' ' A' ' 104' ' ' MET . 6.4 tt -56.17 -29.23 60.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.12 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -88.2 -51.64 5.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.266 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 m -64.02 -35.1 79.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.958 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.561 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 27.0 mmtt -78.98 -29.5 43.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.58 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.688 HG13 HG22 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.81 -51.44 40.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.158 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.505 ' N ' HG11 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.65 -37.76 73.9 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.378 178.695 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -37.58 70.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -62.87 -26.97 69.03 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.962 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.724 HG12 ' ND1' ' A' ' 82' ' ' HIS . 20.5 t -62.13 -47.69 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.305 0.574 . . . . 0.0 109.807 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -58.73 -24.27 61.25 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.857 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 8.9 t -87.15 -35.42 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.421 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.772 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -66.31 -38.68 88.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -71.99 -29.11 63.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.406 176.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 120' ' ' ALA . . . -89.61 10.63 22.37 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.558 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.451 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.4 OUTLIER -136.59 -15.96 1.58 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.815 0.341 . . . . 0.0 110.979 179.064 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.5 ' HG3' HD12 ' A' ' 122' ' ' LEU . 8.0 mm100 -88.67 -78.88 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.727 -179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.63 15.27 8.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.077 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.574 ' HG3' ' HB2' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -84.61 -158.14 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.837 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.406 ' N ' ' HD3' ' A' ' 128' ' ' LYS . 7.9 mt-10 -87.32 27.08 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.462 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.574 ' HB2' ' HG3' ' A' ' 128' ' ' LYS . . . -61.25 -28.38 69.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.412 -177.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.13 168.32 10.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -75.89 -62.41 1.6 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 5.0 pttm -80.55 141.34 35.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.049 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.82 85.82 7.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.042 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.17 158.32 2.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.44 83.6 0.81 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 54.2 p -96.24 138.12 34.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.897 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -89.69 125.11 35.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.107 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 1.2 t -98.39 126.03 43.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.79 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . 0.44 ' O ' HG21 ' A' ' 143' ' ' THR . . . -103.96 37.39 3.78 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.509 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.46 HG13 ' HA ' ' A' ' 142' ' ' PRO . 37.6 t -101.45 129.72 26.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.433 0.158 . . . . 0.0 111.002 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.46 ' HA ' HG13 ' A' ' 141' ' ' VAL . 95.4 Cg_endo -80.27 169.87 67.65 Favored 'Cis proline' 0 C--N 1.348 0.539 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.479 0.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.44 HG21 ' O ' ' A' ' 140' ' ' GLY . 29.1 p -105.44 14.7 28.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.856 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.17 -179.864 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.117 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.62 -65.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.608 2.206 . . . . 0.0 112.166 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.79 101.56 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.863 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -106.41 134.35 12.09 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.594 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.1 t -102.31 -17.11 16.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.825 0.345 . . . . 0.0 110.917 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -135.55 141.81 45.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.998 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.64 -73.04 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.093 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -144.3 -44.62 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.09 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.47 124.92 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.71 -51.64 0.1 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.553 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -56.43 118.01 4.76 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.142 1.895 . . . . 0.0 112.294 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.57 13.26 22.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -107.79 82.75 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.159 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 14' ' ' ARG . 18.1 mtt85 -80.66 -67.23 0.79 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.75 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 m -95.14 140.18 30.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.757 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.74 136.88 19.94 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.54 -30.69 9.62 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.443 2.096 . . . . 0.0 112.133 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -93.39 161.02 14.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.81 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -63.96 129.19 39.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.415 ' H ' ' HG2' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -87.29 -163.95 1.01 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.973 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -86.25 39.09 0.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.012 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.02 -59.01 2.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.61 108.79 1.79 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -107.43 0.43 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.436 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.2 t -97.72 120.83 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.853 0.358 . . . . 0.0 111.138 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.53 -55.87 2.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.863 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -82.76 139.36 43.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.953 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -77.66 69.85 7.15 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.604 2.203 . . . . 0.0 112.363 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.54 124.19 34.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -98.74 119.05 36.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.0 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -77.8 -16.92 58.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 120.04 19.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.886 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -104.95 -12.48 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.907 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.97 104.66 15.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.674 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 36.6 mt-30 -98.51 -52.05 0.21 Allowed Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.409 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.674 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 12.6 Cg_exo -70.78 -5.95 18.0 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.379 2.053 . . . . 0.0 112.185 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -81.92 113.47 19.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.102 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.41 18.66 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 15.0 t -80.2 177.08 9.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.998 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.2 mtt -93.5 -169.41 2.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -100.47 153.34 19.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -154.11 135.68 9.01 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.2 132.3 46.06 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.524 2.149 . . . . 0.0 112.164 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.48 95.11 8.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.073 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 p -96.75 -27.65 3.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.39 96.27 8.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 m -109.18 -177.75 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.037 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -55.34 7.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.53 158.4 18.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.372 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -108.26 85.79 2.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.907 0.384 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 20.7 mm-40 -90.69 -50.98 0.33 Allowed Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.363 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.458 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 48.9 Cg_exo -56.98 152.8 41.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.208 1.939 . . . . 0.0 112.267 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.685 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -89.35 148.61 23.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.893 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.496 ' O ' HD21 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.79 -161.86 0.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.666 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -59.59 -36.92 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.382 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.537 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 2.0 m -60.73 -45.7 93.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.405 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.669 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.81 -40.96 94.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.262 0.553 . . . . 0.0 110.113 178.371 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.548 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.04 -47.88 81.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.721 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -8.88 50.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 t -81.75 -9.51 59.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.007 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.599 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -135.12 60.35 39.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.163 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.633 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 51.3 Cg_exo -53.71 -51.48 10.72 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.413 2.075 . . . . 0.0 113.139 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.615 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 78.8 Cg_endo -97.44 31.05 0.15 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.591 2.194 . . . . 0.0 112.676 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -142.67 -93.54 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.536 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.698 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -106.88 43.87 1.12 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.55 -178.278 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.633 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -72.8 -31.78 65.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.932 0.396 . . . . 0.0 110.967 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.615 ' HA ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -128.49 34.85 4.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -133.29 -53.86 0.9 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.876 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.698 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.2 ptt? -80.63 22.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.843 HD12 HD21 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -89.16 -40.9 12.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.118 0.485 . . . . 0.0 110.196 179.384 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.936 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -125.64 13.79 7.27 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -130.1 -2.4 4.56 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 20.4 tpp180 -127.11 -22.9 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.081 0.467 . . . . 0.0 111.107 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.652 ' HB3' HD13 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.99 -17.82 60.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.008 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.488 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 11.2 t80 -46.02 -54.88 14.95 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 27.6 Cg_endo -62.17 -15.27 43.15 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.121 1.88 . . . . 0.0 112.506 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 53' ' ' LEU . 54.2 mt -98.74 -23.38 15.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.898 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.652 HD13 ' HB3' ' A' ' 74' ' ' LEU . 10.2 mm -66.37 -41.28 88.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.371 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.854 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.6 mt-30 -53.25 -18.37 2.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.58 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.56 -36.09 29.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.84 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.511 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -74.84 -51.29 14.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.68 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.689 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.2 m-70 -105.16 160.85 24.6 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.237 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HG2' HD12 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.4 71.72 0.62 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.287 1.991 . . . . 0.0 111.949 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.854 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 50.84 38.98 21.25 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.857 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 25.2 mt -95.42 9.87 38.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.313 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.594 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.35 -141.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.733 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.45 -25.03 7.53 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.654 -178.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.691 ' O ' ' HB3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -156.38 12.28 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.46 0.171 . . . . 0.0 111.362 178.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.666 HG22 HG13 ' A' ' 115' ' ' VAL . 88.0 mt -76.19 -89.23 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 119.811 -0.755 . . . . 0.0 110.202 178.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.936 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.38 -40.64 59.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.075 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.507 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.66 -32.4 54.04 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.31 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.691 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.92 -23.12 31.32 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.815 0.341 . . . . 0.0 110.199 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.702 ' HG ' HG22 ' A' ' 115' ' ' VAL . 4.4 mm? -61.39 -6.66 2.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.389 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.585 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.7 mm? -105.14 24.25 12.33 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 176.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.3 pt-20 -166.86 1.73 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.704 -178.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.898 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.98 -151.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.376 0.608 . . . . 0.0 111.826 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.9 t0 -59.23 -3.44 0.4 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.143 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.58 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.3 m-20 78.08 -28.61 0.16 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.509 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.2 m -74.72 -25.15 58.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.898 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.5 OUTLIER -82.64 -26.15 32.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.596 177.251 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.482 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 2.7 tp -75.06 -25.91 59.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.467 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.1 -47.64 9.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.065 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -37.87 82.76 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.3 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.67 ' HE1' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.22 -35.97 72.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.268 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.843 HD21 HD12 ' A' ' 70' ' ' LEU . 11.5 mt -87.05 -12.85 46.08 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.259 0.552 . . . . 0.0 110.068 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -102.49 -8.01 21.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.19 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.817 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -147.32 134.5 10.22 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.677 0.275 . . . . 0.0 111.722 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.18 2.19 5.22 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.69 2.26 . . . . 0.0 112.24 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 113' ' ' SER . 5.7 mt-10 -126.71 -13.7 5.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.576 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.817 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -73.11 -45.13 58.79 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.045 0.45 . . . . 0.0 110.051 177.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.67 ' HG ' ' HE1' ' A' ' 104' ' ' MET . 7.0 tt -56.88 -30.74 64.17 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.119 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.511 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 0.0 OUTLIER -89.76 -44.75 9.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.301 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -68.03 -35.66 78.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.699 -179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 118' ' ' ALA . 23.7 mmtt -78.79 -29.42 44.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.49 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.702 HG22 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -70.56 -52.19 31.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.634 ' HA ' HG22 ' A' ' 119' ' ' VAL . 7.0 t70 -59.0 -34.88 72.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.394 177.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -29.26 48.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.868 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.607 ' HB3' ' SD ' ' A' ' 92' ' ' MET . . . -69.99 -25.31 63.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.781 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.689 HG11 ' ND1' ' A' ' 82' ' ' HIS . 13.1 t -64.96 -51.49 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.877 177.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.35 -24.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.531 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 121' ' ' VAL . 18.5 t -86.69 -31.96 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.82 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.68 -37.1 62.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -77.62 -22.72 50.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.098 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -81.65 -15.71 53.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.318 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -107.43 -45.5 4.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -59.0 -79.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.45 62.74 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.449 ' O ' ' HG3' ' A' ' 128' ' ' LYS . 3.0 ptpt -64.13 123.82 20.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.79 -174.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.21 4.49 42.33 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.656 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.64 -21.28 60.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.295 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.96 126.68 31.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.988 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -72.59 -71.87 0.27 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.982 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.73 70.36 9.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.971 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.08 141.0 28.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.028 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 6.7 m -76.96 136.94 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -87.29 148.0 25.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.7 m -98.49 -21.49 16.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.944 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.95 125.92 28.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.191 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.3 156.28 18.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.896 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -101.62 -159.99 26.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.501 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.434 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 1.3 t -84.7 124.13 73.4 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.595 0.236 . . . . 0.0 111.004 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 141' ' ' VAL . 16.9 Cg_exo -67.5 82.14 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.686 2.258 . . . . 0.0 112.182 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.81 172.01 8.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.964 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.038 -179.875 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HB2' ' HB3' ' A' ' 5' ' ' SER . 38.3 Cg_exo -57.32 152.73 44.42 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.597 2.198 . . . . 0.0 112.252 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.1 mt -92.49 -34.13 14.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.67 45.84 1.57 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.397 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.436 ' HB3' ' HB2' ' A' ' 2' ' ' PRO . 23.8 p -100.46 -5.34 27.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.722 0.296 . . . . 0.0 111.068 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.88 -41.51 97.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -85.41 -178.85 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.999 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.86 -69.51 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.997 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -162.8 -40.27 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.012 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.2 p -134.62 123.46 16.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.13 -11.72 27.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.47 2.113 . . . . 0.0 112.27 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.44 71.63 10.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.032 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.4 t -107.17 139.24 29.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.081 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -90.23 68.45 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.842 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.81 140.59 37.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.466 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -97.89 -51.06 0.22 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.591 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.505 ' HA ' ' HZ1' ' A' ' 20' ' ' LYS . 72.6 Cg_endo -76.12 68.61 6.6 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.186 1.924 . . . . 0.0 112.379 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -75.16 -173.1 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.946 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -79.3 59.52 2.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.505 ' HZ1' ' HA ' ' A' ' 17' ' ' PRO . 0.6 OUTLIER -102.55 140.1 37.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -66.38 104.82 1.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.973 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.71 -10.47 37.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.86 146.01 26.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.979 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.83 97.59 2.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.54 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.5 m -82.35 -39.67 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.839 0.352 . . . . 0.0 111.005 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.469 ' O ' ' HD3' ' A' ' 28' ' ' PRO . 9.9 mmt-85 -81.17 133.32 35.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.93 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -96.34 105.58 23.37 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 26' ' ' ARG . 31.3 Cg_exo -59.35 92.19 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.567 2.178 . . . . 0.0 112.338 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -99.74 97.96 8.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.769 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -69.83 122.17 18.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.166 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -110.42 34.51 3.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.737 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.43 ' HB3' ' H ' ' A' ' 33' ' ' ASN . 0.2 OUTLIER -96.44 -83.01 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.291 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.43 ' H ' ' HB3' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -96.57 125.24 40.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.096 -179.535 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.72 -3.48 58.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -101.16 133.89 20.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.925 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -57.64 167.85 3.61 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.559 2.173 . . . . 0.0 112.391 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.11 162.4 14.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.883 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.0 t -105.2 -66.8 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.345 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.9 m -86.52 -31.8 21.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.255 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.39 79.08 8.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.116 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -166.0 125.3 1.63 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -122.24 76.59 42.73 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.28 97.91 0.71 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.85 116.07 21.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.0 p -99.57 156.23 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.895 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.5 m80 -79.9 121.7 25.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.028 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 65.5 t -99.61 127.43 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.963 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -93.78 109.99 21.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.939 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.52 41.0 3.03 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.396 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.29 59.53 3.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.866 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -90.9 106.83 17.07 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.1 -173.13 1.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.459 2.106 . . . . 0.0 112.104 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.705 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -83.71 151.76 25.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.907 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.557 ' HA ' HD21 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.12 -169.57 1.5 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.969 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.566 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -56.84 -31.96 65.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -50.64 61.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.676 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.582 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -57.75 -36.38 72.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.915 178.716 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.582 HD13 HD23 ' A' ' 105' ' ' LEU . 13.0 mt -68.22 -41.57 81.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.417 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.505 ' O ' ' HD3' ' A' ' 62' ' ' PRO . . . -61.71 -12.69 17.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.913 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 m -75.29 -13.56 60.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.62 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.775 ' HB2' ' HG2' ' A' ' 65' ' ' GLU . . . -141.61 58.94 9.16 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.107 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.624 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 53.7 Cg_exo -51.82 -51.56 10.89 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.444 2.096 . . . . 0.0 113.063 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.624 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 65.5 Cg_endo -95.76 23.2 0.38 Allowed 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.625 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 28.2 tp60 -135.73 -90.65 0.3 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.775 ' HG2' ' HB2' ' A' ' 61' ' ' ALA . 1.1 pt-20 -106.88 29.56 6.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.755 0.312 . . . . 0.0 111.818 -176.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.54 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -67.31 -60.09 2.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.576 178.733 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.466 ' C ' HD11 ' A' ' 70' ' ' LEU . 2.7 pttm -90.16 29.74 1.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.448 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -124.71 -46.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.967 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.726 ' HG3' ' HG3' ' A' ' 65' ' ' GLU . 43.7 mtm -74.49 -8.98 58.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.696 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.718 HD23 HD22 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -57.94 -52.53 65.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.66 0.267 . . . . 0.0 111.343 -177.807 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.768 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -123.6 23.54 6.68 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.329 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 2.2 mt-10 -136.73 2.31 2.64 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.466 0.174 . . . . 0.0 111.461 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.617 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -125.67 -34.52 2.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.791 ' HB2' HG22 ' A' ' 90' ' ' THR . 2.3 mm? -59.5 -38.48 81.01 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.766 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -26.88 -61.54 0.18 Allowed Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -175.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.766 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 15.9 Cg_exo -69.18 -30.38 25.05 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.078 1.852 . . . . 0.0 112.273 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.705 HD13 ' HB2' ' A' ' 53' ' ' LEU . 96.9 mt -82.12 -17.6 45.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.972 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 74' ' ' LEU . 11.4 mm -73.18 -43.18 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.87 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.4 mt-30 -50.88 -19.54 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.892 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.67 -40.18 29.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.886 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.592 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -70.79 -50.86 31.2 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.494 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.732 ' ND1' HG13 ' A' ' 119' ' ' VAL . 2.2 m-70 -109.08 153.76 42.38 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.572 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.476 ' HG2' HD12 ' A' ' 85' ' ' LEU . 26.1 Cg_endo -61.74 81.0 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.339 2.026 . . . . 0.0 111.789 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.87 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 42.0 33.47 0.37 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.641 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.8 mp -87.63 8.92 23.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.878 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.582 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -75.72 40.42 0.19 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.75 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.18 -12.64 81.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.758 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.754 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.1 ttpt -178.0 34.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.868 0.366 . . . . 0.0 110.668 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.693 HG22 HG22 ' A' ' 119' ' ' VAL . 61.7 mt -80.09 -91.88 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.791 HG22 ' HB2' ' A' ' 74' ' ' LEU . 0.6 OUTLIER -50.85 -40.59 56.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.997 179.694 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.54 53.91 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.144 -1.026 . . . . 0.0 110.916 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.754 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.39 -25.48 33.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.508 -0.346 . . . . 0.0 110.133 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.649 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -59.83 -7.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.742 ' HA ' HD11 ' A' ' 101' ' ' LEU . 1.7 mm? -104.98 27.17 8.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.5 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -168.89 2.18 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.596 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.93 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.385 0.612 . . . . 0.0 111.712 -179.723 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.4 t0 -59.43 -3.05 0.38 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.087 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.59 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 78.63 -29.94 0.15 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.493 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 97' ' ' ASP . 2.1 m -73.61 -27.87 61.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.045 0.45 . . . . 0.0 109.956 178.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.93 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -79.77 -23.48 42.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.097 177.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.742 HD11 ' HA ' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -75.16 -25.23 58.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.833 176.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.6 mp -88.4 -45.56 9.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.085 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.407 ' CD2' ' HE2' ' A' ' 114' ' ' LYS . 1.2 t60 -61.94 -45.95 91.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.759 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.636 ' HE1' ' HB3' ' A' ' 93' ' ' LEU . 0.5 OUTLIER -54.09 -32.74 55.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.409 -179.574 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.718 HD22 HD23 ' A' ' 70' ' ' LEU . 66.5 mt -85.13 -11.68 54.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.801 0.334 . . . . 0.0 111.154 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -110.18 -6.12 15.16 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.529 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -146.8 140.18 14.86 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.678 -0.409 . . . . 0.0 112.064 -178.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.01 3.69 6.41 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.668 2.246 . . . . 0.0 112.056 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -122.01 -22.61 5.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.536 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.529 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.2 p -64.35 -56.94 11.03 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 109.959 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 54' ' ' THR . 6.9 tt -51.64 -28.3 13.99 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.734 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.592 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 7.9 ttt85 -89.86 -60.82 1.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.08 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.42 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 50.3 m -55.65 -34.99 65.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.075 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.553 ' HD3' ' HB3' ' A' ' 100' ' ' GLU . 9.1 mttm -79.2 -32.99 44.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.714 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.674 HG11 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -66.54 -53.61 33.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 177.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.527 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -56.89 -35.72 69.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.375 178.166 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.09 -30.16 60.84 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.948 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.98 -19.64 61.85 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.615 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.732 HG13 ' ND1' ' A' ' 82' ' ' HIS . 18.1 t -68.49 -49.16 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.674 176.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.2 -27.38 63.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.603 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.553 HG12 ' HE2' ' A' ' 92' ' ' MET . 7.7 t -85.32 -31.92 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.477 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.55 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.99 -41.92 73.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.826 178.697 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.491 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mm100 -68.82 -27.92 66.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.413 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.718 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -86.06 -12.85 49.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.891 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.491 ' HA ' ' HB1' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -115.86 8.25 14.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.971 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 8.9 mt-30 -78.14 -103.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.813 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.62 20.14 10.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 111.241 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.718 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 2.8 mttm -81.77 -144.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.959 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -80.48 8.78 6.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.971 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.491 ' HB1' ' HA ' ' A' ' 125' ' ' HIS . . . -80.92 -14.08 58.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.195 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.06 -15.1 58.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.24 98.18 11.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.2 111.93 19.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.891 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.02 143.05 31.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.088 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.1 m -103.93 96.82 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.137 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -93.01 -4.86 51.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.899 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 47.5 p -95.36 -31.92 13.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.934 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -86.05 -179.53 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.06 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.17 -177.25 3.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.835 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.97 -107.69 0.15 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.485 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.05 136.97 19.37 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.557 0.218 . . . . 0.0 111.017 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.33 136.28 62.41 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.57 2.18 . . . . 0.0 112.334 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.1 p -88.24 78.08 8.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.036 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.5 t . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.27 -0.872 . . . . 0.0 111.051 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 CA-C-O 120.152 -0.249 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.44 127.31 25.68 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.729 2.286 . . . . 0.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.92 -23.59 17.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.947 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.31 142.83 15.73 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.419 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.3 p -79.68 82.79 5.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.832 0.348 . . . . 0.0 110.88 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -117.18 -179.12 3.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.09 19.36 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.071 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 57.01 27.41 13.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.207 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -126.64 -59.8 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.77 125.87 7.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.812 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.83 85.08 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.444 2.096 . . . . 0.0 112.302 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.7 75.21 9.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.039 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 m -103.73 137.0 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.135 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -99.62 99.24 10.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.856 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -92.62 70.49 4.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.968 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.64 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 42.3 t -109.01 -52.05 0.07 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.631 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.64 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 46.5 Cg_exo -56.38 161.56 9.2 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.189 1.926 . . . . 0.0 112.27 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -77.22 177.38 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.446 ' HB3' ' H ' ' A' ' 20' ' ' LYS . 13.1 t80 -65.59 -88.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -83.24 -174.26 5.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.914 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -86.71 -18.65 30.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.909 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.68 119.52 19.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.057 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.93 128.81 36.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.77 43.29 3.22 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.485 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -109.67 169.77 3.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.362 . . . . 0.0 111.079 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.8 137.93 38.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -73.56 140.15 78.46 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.03 13.35 2.01 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.536 2.158 . . . . 0.0 112.404 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.97 150.65 20.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.961 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -78.43 -163.73 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.27 -34.84 72.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.3 tp -83.83 134.64 34.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -82.77 134.13 35.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.969 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.92 -86.3 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.064 0.459 . . . . 0.0 111.101 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.16 145.22 32.43 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -77.84 133.43 30.23 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.377 -1.51 . . . . 0.0 112.428 0.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.404 ' NE2' HG11 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -72.83 -179.74 3.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 179.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.409 ' H ' HG11 ' A' ' 38' ' ' VAL . 2.9 p -78.32 87.21 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.5 -63.87 1.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.921 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.72 148.59 24.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.926 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.1 -159.74 0.99 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.851 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 133.12 83.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.955 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.71 140.52 39.27 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.455 2.103 . . . . 0.0 112.314 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.43 96.97 4.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.098 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.3 t -93.61 92.3 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.02 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 63.1 m80 -107.63 19.71 19.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 t -101.11 54.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.45 8.49 27.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -82.08 -18.45 67.21 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.595 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -100.37 122.47 43.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.818 0.342 . . . . 0.0 110.975 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.65 137.77 54.76 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.979 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.455 ' O ' ' HG2' ' A' ' 57' ' ' MET . 95.3 Cg_endo -80.97 163.57 20.42 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.616 2.211 . . . . 0.0 112.636 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.634 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER -81.0 137.21 36.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.844 179.692 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.565 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -173.51 -174.27 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.278 178.42 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.568 ' HA ' HD13 ' A' ' 58' ' ' LEU . . . -49.66 -42.13 44.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.793 -178.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.779 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 49.8 m -59.24 -52.3 66.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 110.679 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.779 ' HE2' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -57.8 -40.24 79.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.639 HD12 HD23 ' A' ' 105' ' ' LEU . 13.9 mt -61.65 -44.33 97.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.048 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -16.53 51.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.976 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.2 t -73.93 -7.03 50.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.608 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.23 60.78 50.96 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.194 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.63 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 47.5 Cg_exo -55.57 -53.08 6.21 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.436 2.091 . . . . 0.0 113.06 -178.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.63 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 62.5 Cg_endo -97.66 22.08 0.33 Allowed 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.536 2.157 . . . . 0.0 112.532 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.461 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 4.4 mm100 -127.69 -95.1 0.43 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.852 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.726 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -106.98 37.76 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -177.259 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.469 ' C ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -70.11 -18.26 63.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.912 179.355 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.552 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.32 24.16 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.111 179.746 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -131.72 -52.82 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.726 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -77.62 15.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.296 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -88.86 -28.86 20.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.266 0.555 . . . . 0.0 110.139 179.267 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.883 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -132.77 11.61 5.15 Favored Glycine 0 N--CA 1.441 -0.988 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.597 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -130.74 -0.69 4.29 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.526 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.17 -21.3 3.95 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.9 0.381 . . . . 0.0 110.702 179.385 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.802 HD11 HD23 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.09 -15.14 60.16 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.032 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.697 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 3.0 t80 -40.06 -54.6 4.36 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.272 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 12.6 Cg_exo -70.33 -22.59 29.27 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.175 1.916 . . . . 0.0 112.125 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 74' ' ' LEU . 1.0 OUTLIER -79.61 -31.5 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.717 -178.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.76 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 7.0 mm -68.69 -42.44 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.855 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.909 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.1 mt-30 -50.78 -18.26 0.7 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.323 0.582 . . . . 0.0 110.366 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.0 -41.58 20.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.835 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.76 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.5 OUTLIER -69.19 -43.71 73.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.464 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.751 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 3.4 m-70 -118.78 149.38 46.38 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.302 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.416 ' HG2' HD12 ' A' ' 85' ' ' LEU . 20.8 Cg_endo -59.67 77.68 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.299 2.0 . . . . 0.0 111.594 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.909 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 16.3 p 47.02 35.54 3.45 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.87 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.751 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -89.04 2.89 53.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.235 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.583 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -61.26 -114.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.756 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.501 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 63.39 -1.37 2.19 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.121 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.615 ' HB3' HD11 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -175.98 -20.62 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.693 HG23 HG12 ' A' ' 115' ' ' VAL . 69.8 mt -50.17 -84.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -177.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.883 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -53.53 -38.17 63.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.533 0.206 . . . . 0.0 110.949 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.11 -29.81 60.03 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.59 176.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.608 ' O ' HG21 ' A' ' 96' ' ' ILE . 2.3 ttp -76.34 -35.09 58.92 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.072 -0.564 . . . . 0.0 110.021 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.716 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.5 mm? -56.28 -11.02 1.02 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.77 -177.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.605 HD11 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.68 28.25 7.66 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -172.86 2.5 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.827 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.982 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.69 -149.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.433 0.635 . . . . 0.0 111.629 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.589 ' N ' HG12 ' A' ' 96' ' ' ILE . 13.0 t0 -53.16 -10.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.852 176.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.715 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.3 OUTLIER 80.6 -25.08 0.18 Allowed 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.824 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -73.48 -31.02 63.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.982 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -73.18 -33.52 65.47 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.82 177.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.457 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 2.3 tm? -65.72 -24.12 66.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.296 178.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.9 mp -89.51 -48.25 7.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.26 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -37.32 81.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.286 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.683 ' HE1' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -59.72 -35.39 74.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.168 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.639 HD23 HD12 ' A' ' 58' ' ' LEU . 15.3 mt -86.78 -11.3 51.4 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.091 0.472 . . . . 0.0 110.066 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -105.63 -7.89 18.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.37 -175.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.853 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -146.58 131.72 9.05 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.673 0.273 . . . . 0.0 111.595 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.66 2.54 3.93 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.635 2.223 . . . . 0.0 112.257 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -125.37 -16.66 5.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.699 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.853 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.3 OUTLIER -70.64 -46.55 63.07 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.006 0.431 . . . . 0.0 110.326 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.802 HD23 HD11 ' A' ' 74' ' ' LEU . 6.2 tt -54.28 -27.53 35.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.971 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.89 -51.93 5.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.362 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.1 t -64.23 -33.91 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.797 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.516 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 12.7 mmtp -78.93 -30.21 44.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.482 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.693 HG12 HG23 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.78 -50.42 49.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.646 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.489 ' HA ' HG23 ' A' ' 119' ' ' VAL . 5.6 t70 -57.32 -39.23 75.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.411 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -73.04 -29.47 63.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.869 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.54 -23.16 61.72 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.851 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.697 HG13 ' ND1' ' A' ' 82' ' ' HIS . 19.8 t -65.0 -48.65 83.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.588 0 CA-C-O 121.297 0.57 . . . . 0.0 109.687 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.15 -26.73 63.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.546 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.46 ' O ' HG12 ' A' ' 121' ' ' VAL . 10.4 t -84.61 -30.69 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.792 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.615 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.91 -39.57 61.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.797 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.421 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.5 mm100 -65.52 -31.03 71.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.152 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.619 ' HB2' ' HG2' ' A' ' 128' ' ' LYS . . . -78.91 -48.75 14.01 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.177 179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -67.63 -22.39 65.33 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.554 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -87.62 -45.0 10.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.285 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.29 -45.25 7.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.803 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.619 ' HG2' ' HB2' ' A' ' 124' ' ' ALA . 1.3 ptpt -95.86 178.51 5.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.526 0.679 . . . . 0.0 111.366 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.574 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 2.3 tt0 -90.04 46.87 1.39 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.076 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.619 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.13 -15.18 8.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.686 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.38 -88.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.271 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -76.26 126.95 31.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.003 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -80.89 -46.07 15.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.856 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -79.22 110.08 14.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.006 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.3 m -104.0 158.74 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.406 ' HB3' ' H ' ' A' ' 137' ' ' SER . 2.7 m120 -87.61 -157.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.406 ' H ' ' HB3' ' A' ' 136' ' ' ASN . 0.0 OUTLIER -82.67 58.7 4.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.98 0.419 . . . . 0.0 110.979 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.23 -173.32 3.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.067 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.71 100.18 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -100.26 -41.61 2.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.436 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 m -101.85 142.59 24.91 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.693 0.282 . . . . 0.0 111.025 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.47 168.66 3.74 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.628 2.219 . . . . 0.0 112.346 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.29 141.39 28.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.869 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.2 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.123 -179.963 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.121 0 CA-C-O 120.147 -0.252 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.14 -34.42 13.33 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.512 2.141 . . . . 0.0 112.264 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 mt -87.88 151.73 22.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.077 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.94 -130.45 4.2 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.425 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.7 t -104.97 102.89 12.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.819 0.342 . . . . 0.0 110.87 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -145.8 86.45 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.144 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.75 -77.84 0.48 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.002 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 55.02 35.65 25.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.187 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.51 21.8 8.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.208 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.407 ' N ' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -93.0 -49.99 0.28 Allowed Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.282 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 10' ' ' THR . 90.0 Cg_endo -78.5 76.71 4.32 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.094 1.863 . . . . 0.0 112.287 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.78 -3.82 57.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.181 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 p -101.42 148.89 6.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.067 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -69.83 123.98 22.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.687 179.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.474 ' HG1' ' HD2' ' A' ' 17' ' ' PRO . 3.6 t -100.9 150.31 22.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.14 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.599 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 5.7 t -101.2 -51.31 0.17 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.536 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.599 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 50.0 Cg_exo -56.5 -39.53 90.68 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.182 1.921 . . . . 0.0 112.302 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -85.93 93.23 8.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.792 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -75.63 161.82 28.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.444 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 tppp? -74.86 115.8 14.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.908 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -0.38 27.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.444 ' H ' ' HG3' ' A' ' 20' ' ' LYS . . . -92.65 48.24 1.36 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.032 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.26 166.31 6.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.083 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.06 49.61 1.23 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.544 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 m -94.95 64.44 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.972 0.415 . . . . 0.0 110.902 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.87 37.23 0.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.943 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.517 ' HB3' ' HD3' ' A' ' 28' ' ' PRO . 10.4 t-20 -87.25 -51.86 0.42 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.305 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 27' ' ' ASN . 87.1 Cg_endo -81.3 83.9 2.07 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.192 1.928 . . . . 0.0 112.424 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.49 98.79 11.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.886 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -96.11 -68.41 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.063 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 56.5 33.81 23.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.924 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.08 75.56 2.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.911 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -107.62 100.58 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.927 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.04 171.63 11.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.127 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.682 ' H ' ' HA ' ' A' ' 36' ' ' PRO . 0.1 OUTLIER -93.59 -50.12 0.27 Allowed Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.68 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.682 ' HA ' ' H ' ' A' ' 35' ' ' GLN . 65.9 Cg_endo -91.93 172.87 20.63 Favored 'Cis proline' 0 C--N 1.356 0.94 0 C-N-CA 124.723 -0.949 . . . . 0.0 112.579 0.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -81.3 115.38 20.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.812 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 t -100.93 -0.94 10.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.15 137.05 33.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.3 ttt -103.55 -18.27 14.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.179 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.44 158.53 23.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.986 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.32 108.26 0.03 OUTLIER Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.142 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.44 155.54 68.21 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.518 2.145 . . . . 0.0 112.265 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -87.58 -177.08 5.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.068 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -101.16 128.52 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.086 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -108.31 -26.24 10.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 22.4 t -102.32 132.4 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.012 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -87.37 -25.48 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.013 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -88.12 89.41 1.6 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.58 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.26 131.2 45.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 110.889 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -85.65 136.3 37.19 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.008 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -81.89 -165.15 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.691 2.261 . . . . 0.0 112.576 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.683 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -90.5 154.69 19.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.833 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.627 ' HA ' HD23 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -171.29 -169.25 0.71 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.91 179.143 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -55.59 -30.85 61.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.631 0.253 . . . . 0.0 111.297 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.2 m -67.23 -49.89 62.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.608 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.683 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.28 -39.92 84.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.212 0.529 . . . . 0.0 110.212 178.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.499 ' CD1' ' HA ' ' A' ' 55' ' ' ALA . 12.5 mt -62.7 -45.5 92.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.634 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -15.03 58.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.912 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.3 t -75.29 -10.34 59.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.696 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -133.2 125.54 18.96 Favored Pre-proline 0 N--CA 1.449 -0.52 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.514 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.539 ' O ' ' N ' ' A' ' 64' ' ' GLN . 42.9 Cg_exo -54.96 -165.63 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.739 2.293 . . . . 0.0 110.643 177.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.409 ' CD ' ' CB ' ' A' ' 62' ' ' PRO . 86.8 Cg_exo -43.03 -15.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.359 1.119 0 C-N-CA 121.796 1.664 . . . . 0.0 112.199 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.596 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 0.4 OUTLIER -40.0 -83.16 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.631 177.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.596 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 1.6 mm-40 -107.17 -1.19 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.281 -179.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.42 ' HB2' ' O ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -55.08 -35.59 64.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.984 0.421 . . . . 0.0 110.549 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.509 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -115.92 29.87 7.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.586 179.376 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.577 ' HB2' ' HA ' ' A' ' 65' ' ' GLU . 10.0 mm-40 -137.57 -57.44 0.69 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.499 ' HE3' ' HA ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -74.45 -8.44 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.902 -178.683 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.643 HD21 HD22 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -58.49 -40.73 83.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.679 0.276 . . . . 0.0 111.34 -179.635 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.836 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.72 27.94 3.02 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.451 -0.88 . . . . 0.0 112.579 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -141.2 -0.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.513 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.08 -22.62 2.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.642 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.688 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -72.9 -21.29 60.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.319 178.467 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.515 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -38.29 -57.15 1.89 Allowed Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.533 -178.12 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 55.5 Cg_endo -69.76 -20.31 35.0 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.982 1.788 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 53' ' ' LEU . 65.7 mt -88.75 -19.49 25.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.631 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.715 HG13 ' HB ' ' A' ' 90' ' ' THR . 13.3 mm -73.85 -38.21 49.89 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.628 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.3 mt-30 -53.84 -16.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.923 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -38.47 28.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.973 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.69 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.22 -46.07 57.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.103 0.477 . . . . 0.0 110.715 -179.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.743 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.1 m-70 -111.88 159.15 34.54 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.762 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.762 ' HG2' HD21 ' A' ' 85' ' ' LEU . 36.4 Cg_endo -64.49 75.86 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.264 1.976 . . . . 0.0 111.871 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.628 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.6 OUTLIER 46.52 38.91 6.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.005 -178.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.762 HD21 ' HG2' ' A' ' 83' ' ' PRO . 0.9 OUTLIER -93.83 4.27 54.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.015 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.657 ' HB1' ' HB ' ' A' ' 78' ' ' ILE . . . -76.48 62.91 1.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.178 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -96.6 -8.05 57.52 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.72 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.5 tptt -177.48 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.891 -0.655 . . . . 0.0 110.158 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.67 HG21 HG22 ' A' ' 119' ' ' VAL . 68.1 mt -79.94 -88.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.359 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.836 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -52.7 -39.98 62.51 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.522 0.201 . . . . 0.0 111.014 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.17 -29.56 52.65 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.582 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.72 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.7 ttp -76.75 -33.66 58.1 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.107 -0.547 . . . . 0.0 109.988 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.699 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.6 mm? -59.47 -5.22 0.75 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.702 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.593 HD23 ' HA3' ' A' ' 71' ' ' GLY . 2.1 mm? -110.3 27.33 9.73 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -170.57 3.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.018 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.898 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -150.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.338 0.59 . . . . 0.0 111.512 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.4 t70 -59.52 -3.01 0.39 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.192 177.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 15.4 m120 78.66 -29.72 0.15 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.48 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.4 ' H ' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -73.09 -32.94 65.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.44 . . . . 0.0 109.938 178.136 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.898 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -74.16 -23.83 59.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.876 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.4 HD13 HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -75.18 -24.7 57.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.892 177.168 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.2 mp -90.2 -45.02 9.37 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.324 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -37.13 82.35 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.936 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.592 ' HE3' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -59.61 -35.87 75.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.285 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.643 HD22 HD21 ' A' ' 70' ' ' LEU . 15.5 mt -87.1 -9.07 56.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.07 0.462 . . . . 0.0 110.058 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -108.93 -5.05 16.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.399 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.842 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.7 OUTLIER -148.54 129.52 7.04 Favored Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.673 -179.411 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.18 0.48 3.24 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.849 2.366 . . . . 0.0 112.555 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -126.31 -19.93 4.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.784 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.842 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -64.03 -47.94 78.27 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.325 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' A' ' 54' ' ' THR . 3.8 tt -50.39 -22.86 2.04 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.769 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -94.16 -62.87 1.26 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.196 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.0 t -50.23 -29.42 9.43 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.564 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 14.2 mmtp -81.18 -43.1 19.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.666 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.699 HG23 ' HG ' ' A' ' 93' ' ' LEU . 1.4 t -64.58 -58.2 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.265 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.643 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -51.02 -41.11 59.6 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.886 0.374 . . . . 0.0 110.83 178.425 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 113' ' ' SER . 12.5 mt-10 -71.68 -32.83 68.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.219 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -68.74 -23.05 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.037 178.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.743 HG12 ' ND1' ' A' ' 82' ' ' HIS . 21.2 t -65.28 -47.97 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 109.676 176.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.55 -27.68 64.79 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.482 177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.481 ' O ' HG13 ' A' ' 121' ' ' VAL . 23.3 t -83.54 -32.42 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.693 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.681 HD22 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -72.83 -41.06 65.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.173 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.3 mm100 -61.74 -36.63 81.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.017 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.513 ' C ' ' HG2' ' A' ' 128' ' ' LYS . . . -70.65 -78.4 0.08 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.595 177.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.472 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.9 OUTLIER -29.61 -39.25 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.866 0.729 . . . . 0.0 112.555 -177.761 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 124' ' ' ALA . 14.4 mm100 -61.34 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.305 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.57 28.26 3.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.752 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.6 OUTLIER -95.98 -162.71 0.98 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.235 0.54 . . . . 0.0 111.173 179.265 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -88.08 26.81 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.697 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.752 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -59.25 -76.16 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.908 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -91.99 -166.21 1.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.916 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -77.37 162.7 27.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.61 106.94 5.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.864 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.59 -164.75 1.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.039 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.0 p -73.96 -17.0 17.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -84.65 33.34 0.52 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.68 134.18 34.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.934 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.85 -172.15 0.97 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.998 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.5 t -95.78 63.83 2.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.856 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -96.08 103.98 3.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.522 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 17.9 m -83.6 140.13 41.18 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.561 0.22 . . . . 0.0 111.122 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.87 140.32 58.21 Favored 'Cis proline' 0 C--N 1.348 0.507 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.371 0.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 m -99.75 110.45 22.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.808 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.101 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 120.218 -0.212 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.55 121.45 9.99 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.704 2.27 . . . . 0.0 112.165 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.89 -33.69 26.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.925 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.11 42.71 2.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 78.9 p -81.23 -51.59 8.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.75 0.31 . . . . 0.0 110.893 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.23 87.49 2.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.081 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.13 28.31 1.71 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.108 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 163.48 9.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.68 170.05 2.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.096 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 4.9 m 60.27 100.79 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.174 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.944 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' ' 10' ' ' THR . 72.7 Cg_endo -76.34 154.17 97.65 Favored 'Cis proline' 0 C--N 1.35 0.624 0 C-N-CA 123.538 -1.443 . . . . 0.0 112.468 0.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.32 -52.78 4.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.063 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -107.61 174.48 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.135 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -49.67 9.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.42 152.34 20.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.955 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.406 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 43.9 t -99.26 127.08 35.66 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 20.4 Cg_exo -66.39 -148.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.739 2.293 . . . . 0.0 112.139 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -70.75 150.26 46.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.746 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -59.9 139.84 57.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.065 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -162.64 0.82 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 91.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.884 0.373 . . . . 0.0 110.85 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.05 93.87 9.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.992 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.51 122.59 23.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.04 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.35 80.97 1.36 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.587 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -101.64 -13.99 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.92 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -12.09 53.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.842 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -93.82 123.06 60.78 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.861 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -60.51 92.46 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.591 2.194 . . . . 0.0 112.17 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -94.33 153.38 18.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.854 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -75.15 -177.19 3.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.97 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -140.17 31.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 33' ' ' ASN . 0.5 OUTLIER -72.82 -28.97 62.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.035 -179.734 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.422 ' N ' ' HG ' ' A' ' 32' ' ' LEU . 26.8 m120 -102.73 31.69 4.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.78 -3.56 58.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.023 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -77.82 124.42 86.31 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 153.65 77.26 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.466 2.11 . . . . 0.0 112.165 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.727 ' HB3' ' HB2' ' A' ' 40' ' ' MET . 2.2 mp0 -93.7 96.7 9.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.92 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.98 -27.26 6.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.019 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -80.69 -10.75 59.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.895 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.727 ' HB2' ' HB3' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -91.14 96.14 10.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.978 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -97.55 86.95 3.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.808 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.96 98.23 3.16 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.42 94.66 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.568 2.179 . . . . 0.0 112.287 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.68 150.32 34.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.109 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.486 HG13 ' HB3' ' A' ' 80' ' ' ALA . 14.7 m -93.24 25.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -102.14 -29.46 11.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.066 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.64 -176.94 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.075 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -95.14 38.92 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.64 -77.6 1.38 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.536 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.45 110.85 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.819 0.342 . . . . 0.0 110.915 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.71 114.09 58.46 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.893 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.14 163.33 8.06 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.626 2.218 . . . . 0.0 112.449 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.705 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -85.77 152.51 22.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.998 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.864 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.08 -175.56 4.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.186 179.019 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.555 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -52.94 -32.68 47.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.342 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.566 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 9.3 m -67.19 -49.05 66.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.602 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.587 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.22 -37.04 76.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.318 0.58 . . . . 0.0 110.154 178.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.481 ' CD1' HD23 ' A' ' 105' ' ' LEU . 16.3 mt -64.51 -44.31 91.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.563 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.25 -10.4 41.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.577 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -75.37 -2.92 30.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -131.39 110.39 15.07 Favored Pre-proline 0 N--CA 1.452 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.831 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.557 ' O ' ' N ' ' A' ' 64' ' ' GLN . 45.4 Cg_exo -55.62 -160.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.191 2.594 . . . . 0.0 110.891 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.477 ' CD ' ' CB ' ' A' ' 62' ' ' PRO . 73.8 Cg_exo -42.56 -12.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 122.005 1.803 . . . . 0.0 113.138 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 62' ' ' PRO . 25.4 mm100 -42.7 -85.62 0.0 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.04 0.448 . . . . 0.0 110.58 176.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.734 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -107.09 -78.97 0.58 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.976 177.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER 56.59 -72.44 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.904 0.752 . . . . 0.0 110.658 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -89.94 19.52 4.82 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.319 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.734 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 3.2 mm100 -116.91 -38.44 3.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.355 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.602 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 33.5 mtm -80.76 -7.73 59.47 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.799 HD11 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -60.71 -35.64 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -178.558 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.799 ' H ' HD11 ' A' ' 70' ' ' LEU . . . -143.01 28.26 2.13 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.096 -1.05 . . . . 0.0 112.988 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -139.27 -6.53 1.38 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.778 0.323 . . . . 0.0 111.16 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.502 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.0 tmt_? -127.68 -19.48 4.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.132 0.491 . . . . 0.0 109.898 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.726 HD12 HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -77.78 -26.35 49.69 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.76 178.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.532 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -38.75 -52.71 3.57 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.316 -177.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 14.2 Cg_exo -71.17 -22.78 25.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.289 1.993 . . . . 0.0 112.819 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.705 HD13 ' HB2' ' A' ' 53' ' ' LEU . 58.4 mt -88.02 -23.17 23.87 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.807 HG13 ' HB ' ' A' ' 90' ' ' THR . 5.6 mm -72.16 -37.49 59.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 110.413 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.822 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.7 mt-30 -54.2 -14.75 1.22 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.283 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.486 ' HB3' HG13 ' A' ' 45' ' ' VAL . . . -84.12 -36.66 22.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.843 178.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -72.43 -35.27 68.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.015 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.685 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.2 m-70 -121.91 162.09 38.86 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 -179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.07 72.3 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.625 2.217 . . . . 0.0 111.948 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.822 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 51.11 24.76 2.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.287 -179.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.421 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 9.1 mt -85.39 5.15 32.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.936 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.705 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -83.01 47.55 1.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.259 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -91.76 12.47 69.33 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.004 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.938 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 5.1 ttpt -177.58 -13.51 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.697 HD11 HG21 ' A' ' 119' ' ' VAL . 36.7 mt -49.85 -82.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.807 ' HB ' HG13 ' A' ' 78' ' ' ILE . 0.5 OUTLIER -53.49 -38.12 63.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.509 0.195 . . . . 0.0 110.786 -178.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.65 -28.85 65.95 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.48 176.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.938 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.5 ttm -75.85 -38.24 58.19 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.458 0.647 . . . . 0.0 109.885 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.583 HD12 ' HE3' ' A' ' 104' ' ' MET . 4.5 mm? -54.7 -9.55 0.35 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.486 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.779 ' HA ' HD13 ' A' ' 101' ' ' LEU . 5.0 mp -105.74 28.55 7.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -172.43 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.407 -178.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.963 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.32 -150.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.323 0.583 . . . . 0.0 111.734 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.495 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -57.72 -5.7 0.42 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.858 177.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.547 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-20 79.62 -25.63 0.18 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.236 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.4 50.78 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.963 ' HB2' HG13 ' A' ' 96' ' ' ILE . 3.9 mt-10 -76.07 -24.28 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.776 177.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.779 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -75.2 -26.03 58.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.023 177.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 mp -90.72 -44.95 9.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.038 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.53 -41.65 96.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.04 -178.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.925 ' HE1' HD23 ' A' ' 111' ' ' LEU . 7.0 ptm -56.75 -37.5 71.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.812 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 70' ' ' LEU . 56.5 mt -80.44 -11.61 59.66 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.232 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -4.4 14.38 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.747 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -144.2 134.65 12.08 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.164 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 7.8 Cg_exo -72.92 3.55 4.37 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.984 2.456 . . . . 0.0 111.671 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' A' ' 113' ' ' SER . 28.5 mt-10 -126.15 -14.41 6.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.656 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.747 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -76.28 -47.21 24.57 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.925 HD23 ' HE1' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.78 -40.4 13.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.429 176.114 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.551 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 0.3 OUTLIER -81.88 -65.53 1.0 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.573 -179.44 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -47.43 -49.72 24.52 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -178.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.66 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.5 mmtp -64.24 -30.96 71.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.193 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.678 HG11 HG22 ' A' ' 89' ' ' ILE . 1.4 t -70.78 -56.48 10.64 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.068 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.123 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.625 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.3 OUTLIER -54.91 -35.68 64.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.021 0.438 . . . . 0.0 110.408 178.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.97 -32.05 61.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.088 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -68.4 -28.99 67.58 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.835 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.697 HG21 HD11 ' A' ' 89' ' ' ILE . 19.7 t -59.68 -49.02 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.158 0.504 . . . . 0.0 109.787 177.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.37 -25.92 51.21 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.701 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.487 ' O ' HG13 ' A' ' 121' ' ' VAL . 9.9 t -86.64 -30.77 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.846 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.714 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.09 -41.02 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.996 179.275 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.463 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 15.1 mm100 -65.27 -35.06 79.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.004 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -72.16 -76.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.52 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.684 ' HA ' ' HE3' ' A' ' 128' ' ' LYS . 0.4 OUTLIER -31.73 -35.22 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.658 0.599 . . . . 0.0 112.142 -178.614 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 124' ' ' ALA . 88.3 mm-40 -70.14 -78.71 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.113 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.73 32.34 2.1 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.71 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.1 OUTLIER -96.4 -156.41 0.53 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.117 0.484 . . . . 0.0 110.83 178.738 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -87.24 23.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.71 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.2 -28.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.181 -178.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.02 -43.64 52.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -83.26 97.44 8.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -89.5 -46.02 8.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.78 167.43 18.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.6 t -89.54 107.85 18.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.67 -18.88 65.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.82 87.97 5.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.885 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.01 122.99 30.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 138.57 42.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.869 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -79.09 -101.01 0.23 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.487 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 23.7 m -77.55 143.94 68.92 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 0.0 111.15 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.98 140.26 93.31 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.619 2.213 . . . . 0.0 112.282 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 80.8 p -93.15 -8.04 43.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.164 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.592 ' H1 ' ' HB3' ' A' ' 6' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.68 -37.18 22.25 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.514 2.142 . . . . 0.0 112.22 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.7 174.79 6.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.983 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.23 25.75 9.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.587 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.44 ' H ' ' HG ' ' A' ' 5' ' ' SER . 4.2 p -96.85 -25.76 15.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.301 . . . . 0.0 110.94 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.592 ' HB3' ' H1 ' ' A' ' 1' ' ' GLY . . . -90.47 174.59 7.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -81.89 -164.54 0.81 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.105 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.35 53.17 9.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.134 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -144.9 -68.21 0.31 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -166.0 134.7 2.46 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.71 16.1 1.35 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.638 2.225 . . . . 0.0 112.499 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.2 63.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.235 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 m -89.84 12.04 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.139 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -96.22 89.98 5.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.858 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 p -97.14 -173.95 2.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.912 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.449 ' H ' HG22 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -113.55 98.49 47.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.139 -179.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -76.27 -41.01 0.52 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.61 2.207 . . . . 0.0 112.366 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -96.15 -173.76 2.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.066 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.61 -167.83 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.039 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.34 14.4 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.963 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -89.21 86.14 6.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.8 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.84 -64.42 1.15 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.09 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 160.56 21.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.069 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.98 -2.46 58.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.594 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.9 p -82.33 140.58 16.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 110.943 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 -81.51 -177.18 6.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.877 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -88.09 108.83 23.64 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.25 -76.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.455 2.104 . . . . 0.0 112.359 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -89.58 115.34 26.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -97.92 178.88 4.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.011 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -123.36 27.26 7.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.815 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.517 HD11 ' H ' ' A' ' 33' ' ' ASN . 0.6 OUTLIER -90.68 169.53 10.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.517 ' H ' HD11 ' A' ' 32' ' ' LEU . 3.6 m-20 -98.26 84.68 3.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.823 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.58 35.62 1.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.683 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 43.3 mm-40 -83.29 -51.96 0.64 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.184 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.683 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 16.6 Cg_exo -67.91 -12.41 35.22 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 122.269 1.98 . . . . 0.0 112.085 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.47 107.51 19.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.019 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -98.61 132.52 43.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.3 t -85.03 136.97 33.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.997 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.9 mtp -103.47 123.16 46.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.958 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 56.35 83.08 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.057 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.89 88.32 4.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.914 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -56.25 102.73 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.618 2.212 . . . . 0.0 112.303 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.03 78.2 6.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.975 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.41 ' H ' HG23 ' A' ' 45' ' ' VAL . 14.7 m -92.66 170.1 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.198 -179.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -86.82 60.33 6.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.826 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.7 p -93.83 142.18 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.023 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -81.65 127.76 33.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -92.68 27.73 10.4 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.535 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -109.11 72.61 0.82 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.888 0.375 . . . . 0.0 110.999 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.24 121.83 75.44 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.851 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.23 -175.56 1.8 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.476 2.117 . . . . 0.0 112.477 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.817 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -80.74 148.17 30.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.022 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.872 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.94 -174.95 3.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.585 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.569 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -50.51 -31.14 14.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.61 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -67.96 -46.85 70.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.865 0.364 . . . . 0.0 110.473 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.802 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.13 -38.12 75.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.787 178.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.66 ' HG ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -64.71 -43.52 93.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 178.159 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.469 ' O ' ' HD3' ' A' ' 62' ' ' PRO . . . -70.89 -2.07 13.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.088 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.469 ' HB2' ' O ' ' A' ' 57' ' ' MET . 74.5 m -86.0 -8.5 57.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.886 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.564 ' HB3' ' H ' ' A' ' 65' ' ' GLU . . . -133.69 53.03 9.28 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.713 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 1.1 Cg_endo -49.43 -49.69 14.97 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.517 2.144 . . . . 0.0 113.568 -178.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.666 ' HD3' ' HG2' ' A' ' 62' ' ' PRO . 55.2 Cg_endo -96.87 4.3 1.71 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.476 2.117 . . . . 0.0 112.81 -178.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -113.27 -97.26 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.494 -178.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.698 ' HB2' ' HG3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.05 45.18 1.0 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.294 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.713 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 2.9 tt0 -62.08 -31.56 72.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -123.14 37.56 4.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.935 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.663 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 6.4 tt0 -128.19 -50.26 1.31 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.679 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.698 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 15.4 mtm -74.46 10.17 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 111.726 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.66 HD23 ' HG ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -74.57 -62.34 1.56 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.58 0.705 . . . . 0.0 110.391 -179.562 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.86 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -114.66 16.6 18.86 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 112.393 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.54 -8.18 4.63 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.544 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -125.97 -17.56 5.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.005 0.431 . . . . 0.0 110.816 -179.582 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.623 ' HA ' HD22 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.09 -10.98 59.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.633 -179.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.461 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 10.4 t80 -49.13 -54.04 32.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.771 -178.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.512 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 44.0 Cg_endo -67.29 -13.61 40.04 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.031 1.821 . . . . 0.0 112.079 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.817 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.0 mm? -86.39 -42.63 13.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.299 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.673 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.3 mm -60.95 -40.5 85.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.851 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.854 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -47.81 -20.45 0.3 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.024 -179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.21 -42.4 15.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.852 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.627 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -68.78 -39.98 79.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.62 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.517 ' CE1' ' CG2' ' A' ' 119' ' ' VAL . 6.2 m170 -123.5 155.82 65.13 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.932 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.21 77.22 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 0.0 111.958 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.854 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 41.36 30.06 0.12 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.719 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.478 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.7 OUTLIER -85.41 8.38 19.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.779 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.673 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.56 12.55 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.874 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -52.95 -22.22 11.96 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.049 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.714 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -161.34 26.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.907 0.384 . . . . 0.0 111.275 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.73 HG23 HG21 ' A' ' 119' ' ' VAL . 62.8 mt -80.77 -87.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.199 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.86 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.91 -39.31 58.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.224 -179.42 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.15 -31.38 61.94 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.033 -1.08 . . . . 0.0 110.632 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.714 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.9 ttp -74.9 -34.31 62.16 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.081 -0.559 . . . . 0.0 110.083 177.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.6 mm? -58.37 -7.12 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.249 -177.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.6 mp -111.62 29.06 8.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 176.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 11.0 pt-20 -167.99 0.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.038 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.997 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.73 -148.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.488 0.661 . . . . 0.0 111.382 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.588 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -57.74 -6.29 0.5 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.7 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.74 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 78.57 -31.58 0.15 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.276 -179.302 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.7 m -67.52 -29.69 69.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.885 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.997 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -74.86 -35.52 62.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.107 177.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.691 ' HG ' HD13 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -65.32 -30.04 70.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.03 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.691 HD13 ' HG ' ' A' ' 101' ' ' LEU . 5.4 mp -81.79 -47.65 12.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.352 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -43.64 92.01 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.529 -177.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.7 ' HE3' HD23 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -55.92 -34.16 65.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.625 -179.078 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.572 HD23 ' SD ' ' A' ' 104' ' ' MET . 21.2 mt -86.25 -11.4 52.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.841 0.353 . . . . 0.0 110.933 -179.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.24 -6.52 17.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -177.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.762 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.37 139.12 16.16 Favored Pre-proline 0 C--N 1.332 -0.184 0 C-N-CA 120.454 -0.498 . . . . 0.0 112.153 -178.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.475 ' O ' HG23 ' A' ' 54' ' ' THR . 72.1 Cg_endo -75.78 2.81 6.6 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.606 2.204 . . . . 0.0 111.778 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -125.52 -12.95 6.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.345 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.762 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.69 -46.22 19.57 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 177.585 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.872 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.46 -40.62 18.69 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.393 176.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.627 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 2.1 ttt85 -79.32 -61.42 2.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.359 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 28.7 t -50.21 -53.13 30.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -178.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 3.7 mmtp -60.11 -29.8 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.373 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.551 HG22 ' HG ' ' A' ' 93' ' ' LEU . 2.0 t -72.91 -62.14 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.092 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.64 ' HA ' HG23 ' A' ' 119' ' ' VAL . 7.7 t0 -49.23 -35.12 16.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.995 0.426 . . . . 0.0 110.749 178.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -43.53 61.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.448 178.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.473 ' CB ' HD23 ' A' ' 93' ' ' LEU . . . -62.12 -22.31 65.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.998 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.73 HG21 HG23 ' A' ' 89' ' ' ILE . 57.9 t -65.35 -45.88 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.688 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.87 -27.34 65.08 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.428 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 22.4 t -83.07 -33.2 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.477 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.592 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.41 -38.95 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.959 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -67.48 -28.69 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.019 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.92 -8.85 53.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.204 179.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -121.68 8.5 10.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.751 -178.825 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -74.17 -109.91 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.417 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.55 33.24 1.65 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 110.905 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.09 -143.0 0.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.025 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.27 15.43 4.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.106 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.56 87.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.081 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -74.79 127.15 32.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -77.0 95.16 4.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.971 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -82.56 -13.4 56.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.898 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.26 157.32 37.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.032 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 21.4 m -79.09 -170.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -68.16 90.45 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.907 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.6 m -103.5 91.58 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.009 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -76.44 82.17 3.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.981 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.67 92.8 9.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.56 -62.42 1.04 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.41 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.706 ' H ' ' HA ' ' A' ' 142' ' ' PRO . 17.2 t -95.6 -47.93 0.26 Allowed Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.706 ' HA ' ' H ' ' A' ' 141' ' ' VAL . 93.6 Cg_endo -88.97 -46.78 0.17 OUTLIER 'Cis proline' 0 C--N 1.356 0.961 0 C-N-CA 124.566 -1.014 . . . . 0.0 112.857 1.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.8 p -102.65 168.08 9.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.209 -0.9 . . . . 0.0 111.022 -179.975 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.158 0 N-CA-C 112.442 -0.263 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -56.53 -29.07 77.04 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.585 2.19 . . . . 0.0 112.304 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tp -97.05 125.92 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.874 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.18 152.73 24.74 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.62 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -98.14 101.45 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.767 0.318 . . . . 0.0 110.833 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.22 76.15 0.31 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.088 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.42 101.9 11.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.263 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.42 -161.08 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.17 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.32 53.85 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.117 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.481 HG21 ' HA ' ' A' ' 11' ' ' PRO . 7.7 m -145.99 127.19 7.43 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.807 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.481 ' HA ' HG21 ' A' ' 10' ' ' THR . 67.6 Cg_endo -74.35 -177.74 20.89 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.362 0.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.63 -18.4 54.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.141 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.41 ' O ' HG11 ' A' ' 13' ' ' VAL . 9.3 p -93.06 137.19 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.188 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -99.83 -26.45 14.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.798 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t -106.07 69.97 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.866 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.4 p -99.39 130.7 26.42 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.87 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.5 111.55 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.499 2.133 . . . . 0.0 112.25 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -83.17 126.07 32.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -72.92 -175.84 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.917 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -88.99 23.86 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.912 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -88.69 -31.15 18.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.955 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.88 14.77 24.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.05 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.43 109.57 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.38 25.02 28.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.03 55.45 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.958 0.409 . . . . 0.0 111.114 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.02 -34.79 50.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.894 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -80.46 151.54 72.03 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.043 -179.62 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.438 ' O ' ' HA ' ' A' ' 27' ' ' ASN . 3.0 Cg_exo -76.23 -77.13 0.0 OUTLIER 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.868 -1.305 . . . . 0.0 112.281 0.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -94.44 -106.56 0.13 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.694 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -100.43 161.15 13.79 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.705 0.288 . . . . 0.0 110.875 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -87.72 8.92 23.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.921 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.27 143.53 36.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.954 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -93.74 133.96 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.987 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.75 28.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.994 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -98.67 104.17 23.02 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.854 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.08 -18.78 18.28 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.519 2.146 . . . . 0.0 112.331 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.24 172.22 13.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.799 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.441 ' H ' HG23 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -101.56 95.13 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.098 -179.859 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.44 82.23 2.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.939 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.31 94.0 6.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.852 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.72 129.63 35.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.093 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -155.21 97.85 2.4 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.57 94.58 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.596 2.197 . . . . 0.0 112.272 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -89.02 58.2 4.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.8 t -81.91 -56.26 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.342 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.64 170.31 9.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.99 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.72 103.72 13.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.923 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -91.89 -85.79 0.24 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.35 120.63 6.57 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.579 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.459 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -94.39 172.79 7.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.796 0.331 . . . . 0.0 110.707 179.742 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -91.07 105.69 13.3 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 96.1 Cg_endo -80.64 170.87 15.23 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.569 2.179 . . . . 0.0 112.247 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.706 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -97.58 148.91 22.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.62 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.69 -163.29 0.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.451 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.561 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -57.84 -40.24 79.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.447 -179.01 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.439 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 63.2 m -58.69 -45.69 88.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.871 0.367 . . . . 0.0 110.533 179.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.706 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.83 -42.2 97.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.28 178.687 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.609 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 0.0 OUTLIER -58.21 -47.29 83.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.57 178.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.67 -10.35 51.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.326 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' MET . 41.5 t -82.45 -7.1 59.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.022 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 64' ' ' GLN . . . -134.34 55.96 16.72 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.58 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.532 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.7 Cg_exo -55.19 -50.15 14.01 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.423 2.082 . . . . 0.0 113.288 -179.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.532 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.5 Cg_endo -87.45 -7.63 6.63 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 122.209 1.94 . . . . 0.0 112.715 -179.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.577 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 3.8 tp-100 -95.41 -83.56 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.638 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -104.92 -87.31 0.45 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.206 -179.292 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.465 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 1.6 mt-30 73.09 -62.64 0.46 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.513 -178.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 24.06 13.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.86 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.638 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 1.6 mt-30 -118.62 -53.88 2.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.357 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.609 ' HE1' ' HA ' ' A' ' 58' ' ' LEU . 4.4 ptt? -81.08 3.82 22.0 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.717 HD13 ' H ' ' A' ' 71' ' ' GLY . 0.0 OUTLIER -65.21 -42.44 93.5 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.048 179.7 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.832 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -132.22 34.48 2.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.327 -0.939 . . . . 0.0 112.83 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.51 -3.43 0.72 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.959 0.409 . . . . 0.0 111.196 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -128.48 -21.56 3.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.117 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.68 HD12 HD21 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.59 -18.71 58.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.365 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.455 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -44.61 -56.14 9.0 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.97 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.456 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 60.0 Cg_endo -71.76 -8.96 24.1 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.054 1.836 . . . . 0.0 112.092 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.503 HD12 ' HB2' ' A' ' 53' ' ' LEU . 73.2 mt -97.34 -24.32 15.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.397 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -69.56 -36.91 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 177.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.817 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.5 mt-30 -51.6 -15.63 0.49 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.364 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -81.77 -42.61 19.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.611 178.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.697 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.75 -30.63 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.374 179.21 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.657 ' ND1' HD13 ' A' ' 89' ' ' ILE . 15.1 m170 -124.73 156.89 67.67 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.848 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.803 ' HD2' HD11 ' A' ' 85' ' ' LEU . 12.4 Cg_exo -67.7 73.86 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.297 1.998 . . . . 0.0 110.465 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.817 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.3 t 45.0 34.06 1.17 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.112 -177.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.803 HD11 ' HD2' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -84.73 2.6 41.25 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.329 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -77.07 60.89 1.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.81 -8.94 61.58 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 177.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.679 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.4 ttpt -176.49 30.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.14 -0.53 . . . . 0.0 110.54 179.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.733 HG22 HG12 ' A' ' 115' ' ' VAL . 64.2 mt -80.2 -90.81 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.323 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.832 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.48 -42.8 55.1 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.122 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.06 -32.7 50.13 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.304 -0.95 . . . . 0.0 111.137 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.679 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -85.08 -21.32 29.39 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 120.812 0.339 . . . . 0.0 110.405 179.175 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.671 ' HG ' HG21 ' A' ' 115' ' ' VAL . 4.0 mm? -61.48 -6.41 2.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.953 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.652 HD13 ' HA3' ' A' ' 71' ' ' GLY . 3.1 mp -104.56 24.8 11.12 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.038 176.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.483 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.6 pt-20 -165.85 0.7 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.559 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.913 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.5 -153.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.519 0.676 . . . . 0.0 111.93 -179.593 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.44 ' N ' HG12 ' A' ' 96' ' ' ILE . 2.2 t70 -58.98 -3.92 0.41 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.17 177.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.632 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.84 -35.06 0.14 Allowed 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.156 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.5 m -66.14 -26.91 67.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.794 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.913 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -83.4 -24.68 31.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.503 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.678 ' HB2' HD12 ' A' ' 96' ' ' ILE . 2.2 tm? -74.86 -26.25 59.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.546 176.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.8 mp -88.75 -46.1 9.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.422 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.469 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -68.02 -36.25 79.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.644 -177.866 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.657 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 7.0 ptm -60.8 -34.92 75.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 110.941 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.495 HD12 HD23 ' A' ' 70' ' ' LEU . 27.5 mt -84.32 -13.77 51.51 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.799 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.469 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.67 -10.67 16.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.849 -177.75 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -139.37 131.88 15.33 Favored Pre-proline 0 C--N 1.33 -0.258 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.969 -178.665 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.484 ' HA ' ' HB ' ' A' ' 54' ' ' THR . 7.1 Cg_exo -73.35 7.81 2.06 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.976 2.45 . . . . 0.0 111.859 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -127.59 -27.65 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.254 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.821 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.47 -49.26 74.34 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.68 HD21 HD12 ' A' ' 74' ' ' LEU . 5.8 tt -50.43 -32.9 19.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.31 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -59.32 2.34 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.379 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -57.28 -34.15 68.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.815 0.341 . . . . 0.0 111.175 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 20.0 mmtt -78.76 -29.2 45.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.354 179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.733 HG12 HG22 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.46 -53.14 23.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.65 ' HA ' HG22 ' A' ' 119' ' ' VAL . 22.8 t0 -56.85 -36.21 69.75 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.944 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -34.76 60.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.901 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.603 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -63.69 -29.94 71.1 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.446 177.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.65 HG22 ' HA ' ' A' ' 116' ' ' ASP . 23.6 t -55.46 -57.34 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.795 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.405 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -52.25 -24.51 7.44 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.416 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.505 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 10.7 t -87.02 -31.93 6.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.715 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.7 -43.12 66.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.918 178.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.536 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -67.06 -31.44 71.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.107 178.879 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.759 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -81.75 -12.16 58.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.205 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.505 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -119.26 8.12 11.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.247 -179.254 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -83.78 -99.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.955 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.61 23.62 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.604 0.24 . . . . 0.0 111.508 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.759 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 0.2 OUTLIER -86.62 -149.33 0.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.341 . . . . 0.0 111.185 -179.604 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -78.95 -3.79 46.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.704 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.459 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -63.6 -42.13 98.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.943 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -86.05 -13.54 47.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.79 -164.69 1.21 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.58 160.45 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.952 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -81.92 -53.5 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 4.8 m -93.95 128.44 45.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.011 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.78 -4.77 52.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.902 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.0 p -78.72 155.84 29.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.11 97.84 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.019 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 1.8 m -88.34 154.85 20.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.973 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -104.55 77.47 0.27 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.442 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 16.1 m -87.19 152.85 53.51 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.601 0.238 . . . . 0.0 111.014 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -62.65 174.23 3.04 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.562 2.175 . . . . 0.0 112.323 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 40.6 p -82.29 113.89 20.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.965 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.087 179.81 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.11 -22.21 54.75 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.588 2.192 . . . . 0.0 112.354 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.67 112.73 24.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.39 -8.59 57.43 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.602 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -104.96 128.83 53.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.933 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -114.13 91.93 3.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.111 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.29 170.5 8.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.062 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.46 158.84 30.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.071 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.87 170.05 10.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.6 p -71.5 138.98 83.67 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.054 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -79.22 154.09 89.68 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.504 -1.457 . . . . 0.0 112.395 -0.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.56 35.91 0.89 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.984 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 13.4 p -81.89 -22.15 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.065 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.41 116.25 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.9 p -111.74 131.66 55.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.874 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.4 p -98.64 130.56 27.64 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.85 176.58 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.551 2.168 . . . . 0.0 112.276 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.26 135.53 33.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.945 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -73.67 -12.45 60.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.1 mttm -82.02 174.73 10.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -16.86 64.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.965 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.09 80.62 6.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.028 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.41 106.25 2.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.12 33.03 4.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.416 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 p -87.02 3.24 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.993 0.425 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -84.57 44.62 1.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.975 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -71.85 140.81 83.92 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.898 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.99 24.81 0.62 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.609 2.206 . . . . 0.0 112.497 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.15 32.29 0.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.976 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -76.89 -75.94 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.963 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.79 -18.6 6.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.007 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.59 122.25 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.871 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -82.71 143.66 30.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.009 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.82 1.86 37.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.86 113.5 50.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.848 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.74 156.8 56.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.38 2.053 . . . . 0.0 112.442 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -80.29 172.64 13.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.06 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.68 HG23 ' HB2' ' A' ' 40' ' ' MET . 7.0 p -86.2 135.6 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.878 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.45 44.43 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.68 ' HB2' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.46 -168.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.951 -179.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.0 93.85 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.84 83.92 0.22 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.21 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.96 124.57 14.71 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.524 2.149 . . . . 0.0 112.155 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 134.44 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.036 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.5 p -98.16 78.15 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.293 0.568 . . . . 0.0 110.964 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -109.89 -56.01 2.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.694 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.6 p -106.06 146.32 12.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -29.23 54.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.104 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -100.58 95.26 1.4 Allowed Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.567 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.488 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.5 mt-30 -94.62 96.33 9.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -91.13 105.06 11.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.902 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.488 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 83.0 Cg_endo -80.88 -117.6 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.642 2.228 . . . . 0.0 112.295 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.603 HD13 ' SD ' ' A' ' 69' ' ' MET . 0.2 OUTLIER -69.09 135.34 50.62 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.881 0.372 . . . . 0.0 110.951 -179.852 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.867 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -170.96 -177.14 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.968 178.308 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.529 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -50.84 -34.43 27.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.492 ' HG ' ' HE2' ' A' ' 57' ' ' MET . 0.3 OUTLIER -68.4 -48.36 64.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.917 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.492 ' HE2' ' HG ' ' A' ' 56' ' ' SER . 0.0 OUTLIER -57.89 -41.12 81.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.194 0.521 . . . . 0.0 110.043 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.637 HD12 HD21 ' A' ' 105' ' ' LEU . 6.6 mt -63.91 -44.44 92.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.595 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 62' ' ' PRO . . . -62.96 -9.84 11.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.002 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.7 m -84.15 -8.84 58.97 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.999 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.702 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.77 54.01 11.58 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.506 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.608 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 60.3 Cg_endo -102.89 120.65 0.06 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.106 2.537 . . . . 0.0 113.064 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 81.5 Cg_endo -98.62 32.33 10.58 Favored 'Cis proline' 0 N--CA 1.455 -0.761 0 C-N-CA 124.459 -1.059 . . . . 0.0 112.064 -0.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.563 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 2.9 tm0? -54.17 -89.54 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.462 -178.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.866 ' HG3' ' HG2' ' A' ' 69' ' ' MET . 1.8 pt-20 -107.81 20.07 19.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.748 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.486 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -53.06 -52.85 57.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.101 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.484 ' H ' ' HG2' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -99.26 34.91 2.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.1 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.518 ' C ' HD11 ' A' ' 70' ' ' LEU . 49.4 mm-40 -133.17 -49.84 0.87 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.145 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.866 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -79.49 -7.73 58.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.909 -178.652 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -60.95 -34.56 74.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.658 0.266 . . . . 0.0 111.477 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.637 ' HA3' HD13 ' A' ' 94' ' ' LEU . . . -138.61 28.69 2.64 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.798 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -137.62 -7.31 1.7 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.866 0.365 . . . . 0.0 111.139 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -19.98 4.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.217 0.532 . . . . 0.0 109.837 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.639 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -78.44 -31.41 48.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.65 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.473 ' HD1' ' HA ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -40.27 -53.49 5.23 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.142 -177.355 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 42.9 Cg_endo -68.21 -21.42 42.0 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.951 1.768 . . . . 0.0 112.138 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 53' ' ' LEU . 92.0 mt -88.61 -19.76 25.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.316 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.741 HG13 ' HB ' ' A' ' 90' ' ' THR . 20.8 mm -71.73 -35.99 57.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.91 0.386 . . . . 0.0 110.135 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.477 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.1 OUTLIER -53.35 -17.15 1.66 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.424 0.63 . . . . 0.0 109.895 177.548 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.08 -38.57 27.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.621 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.582 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -69.8 -42.14 74.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.586 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.766 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.5 m-70 -122.25 152.0 59.89 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.953 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.488 ' HG2' HD13 ' A' ' 85' ' ' LEU . 19.8 Cg_endo -57.45 82.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.358 2.038 . . . . 0.0 111.565 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.477 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 14.1 t 40.16 37.63 0.42 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.416 -178.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.718 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -91.54 7.4 41.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.02 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.585 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -78.84 44.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.586 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.43 -11.64 84.94 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.536 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.626 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -175.57 32.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.687 HG23 HG11 ' A' ' 115' ' ' VAL . 70.7 mt -80.49 -89.44 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.026 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.741 ' HB ' HG13 ' A' ' 78' ' ' ILE . 0.6 OUTLIER -50.17 -42.18 50.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.258 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.45 -31.44 57.12 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.078 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.635 ' O ' HG22 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -83.96 -23.51 31.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 115.561 -0.319 . . . . 0.0 110.145 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.756 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.4 mm? -60.7 -9.06 3.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.403 178.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.703 ' HA ' HD11 ' A' ' 101' ' ' LEU . 4.8 mp -105.1 26.51 9.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 4.8 pt-20 -167.79 1.11 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.3 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.949 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.82 -154.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.486 0.66 . . . . 0.0 111.792 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.42 ' C ' ' H ' ' A' ' 99' ' ' SER . 6.3 t0 -59.54 -2.82 0.38 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.201 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.533 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.79 -35.25 0.17 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.127 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.455 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -67.02 -25.82 66.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.89 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.949 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.9 mt-10 -84.18 -24.08 30.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.631 177.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.703 HD11 ' HA ' ' A' ' 94' ' ' LEU . 1.4 tp -74.82 -27.21 60.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.388 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -88.1 -47.86 8.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.091 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.455 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -63.81 -40.9 97.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.53 -178.586 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.921 ' HE2' HD23 ' A' ' 111' ' ' LEU . 7.7 ptm -56.4 -39.03 72.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.562 0.22 . . . . 0.0 111.218 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.637 HD21 HD12 ' A' ' 58' ' ' LEU . 4.5 mt -85.82 -7.55 58.66 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.167 0.508 . . . . 0.0 110.284 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -109.38 -6.51 15.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.966 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.713 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -147.06 129.79 7.87 Favored Pre-proline 0 C--N 1.328 -0.348 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.691 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.9 Cg_exo -67.78 1.32 3.35 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.78 2.32 . . . . 0.0 112.055 179.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.4 -11.22 6.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.527 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.713 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.92 -45.51 23.85 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.172 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.921 HD23 ' HE2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -46.59 -41.12 14.03 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.614 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.582 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 2.4 ttt180 -79.29 -62.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.306 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.4 t -49.74 -54.34 19.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.342 . . . . 0.0 111.221 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.774 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.2 mmtt -58.88 -29.84 67.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.338 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.687 HG11 HG23 ' A' ' 89' ' ' ILE . 1.4 t -73.92 -55.45 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.076 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.636 ' HA ' HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -55.46 -33.15 63.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.059 0.457 . . . . 0.0 110.594 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -39.24 50.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.551 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -61.28 -24.37 66.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.821 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.766 HG12 ' ND1' ' A' ' 82' ' ' HIS . 15.6 t -66.82 -50.96 60.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.926 177.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.26 -24.96 58.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.655 177.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 121' ' ' VAL . 8.4 t -85.57 -32.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.635 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.61 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.35 -36.61 60.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.077 179.331 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.78 -39.44 94.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -64.54 -79.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.41 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.802 ' HA ' ' HE3' ' A' ' 128' ' ' LYS . 1.6 t60 -33.16 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.72 0.638 . . . . 0.0 112.122 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 124' ' ' ALA . 11.5 mt-30 -73.74 -76.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.212 178.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.38 30.92 2.37 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.802 ' HE3' ' HA ' ' A' ' 125' ' ' HIS . 0.0 OUTLIER -96.49 -156.15 0.51 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.152 0.501 . . . . 0.0 110.838 178.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.31 21.24 2.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.23 176.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.671 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.44 -51.8 68.33 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.311 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -85.9 -162.61 0.76 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.086 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.5 -79.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.001 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -89.41 175.88 7.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.007 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.84 -28.17 65.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.003 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 5.0 t -76.88 147.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -82.08 148.16 28.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.9 t -99.85 161.57 13.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.795 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.98 -166.52 0.16 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.075 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.6 p -87.07 -72.01 0.53 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -89.63 72.22 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.365 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -95.62 104.82 17.32 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.552 0.215 . . . . 0.0 111.087 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -79.22 133.22 10.75 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 0.0 112.363 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 13.1 t -100.37 -15.58 17.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.716 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.006 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.122 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.36 137.9 31.8 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.58 2.187 . . . . 0.0 112.277 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.65 -23.02 16.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.44 75.12 2.35 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.496 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.5 m -85.86 80.78 8.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -128.92 179.61 5.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.022 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -92.03 89.11 6.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.473 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . . . -164.39 105.69 0.87 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -151.79 -20.66 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.089 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.697 ' H ' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -154.3 -53.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.514 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.697 ' HD2' ' H ' ' A' ' 10' ' ' THR . 39.5 Cg_endo -66.02 -38.56 21.9 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.129 1.886 . . . . 0.0 112.161 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.473 ' HB1' ' HB3' ' A' ' 8' ' ' ALA . . . -87.5 69.28 9.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.052 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.462 HG22 ' N ' ' A' ' 14' ' ' ARG . 11.7 p -82.56 147.9 5.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.048 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.462 ' N ' HG22 ' A' ' 13' ' ' VAL . 29.4 ptt-85 -90.43 6.19 44.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.072 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.417 ' H ' HG22 ' A' ' 13' ' ' VAL . 17.1 p -102.81 159.97 15.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.936 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.515 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 7.0 t -98.39 -52.17 0.21 Allowed Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.634 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.515 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 60.9 Cg_endo -72.45 131.63 17.86 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.093 1.862 . . . . 0.0 112.391 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -82.96 162.53 21.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.964 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.32 -89.46 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.86 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' H ' ' HG2' ' A' ' 20' ' ' LYS . 2.7 ptmt -72.54 121.19 19.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.833 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -79.99 163.5 24.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.36 -55.83 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.23 124.18 27.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.018 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -21.33 64.64 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.57 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.7 t -106.13 135.24 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.117 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -95.82 160.83 14.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.24 144.42 92.27 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.921 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -66.96 91.2 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.543 2.162 . . . . 0.0 112.308 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -99.66 24.15 8.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.005 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -86.56 -91.06 0.1 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.902 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -169.37 -34.14 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.038 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 pp -69.62 155.78 39.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.993 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -98.17 86.5 3.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.63 90.99 6.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.045 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.493 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 29.0 mm100 -81.49 -51.35 0.87 Allowed Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.312 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.493 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 96.7 Cg_endo -79.49 68.34 8.32 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.178 1.919 . . . . 0.0 112.414 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -93.24 24.32 3.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.846 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.6 m -81.07 -18.04 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.014 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.1 117.91 22.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.968 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.85 -178.45 3.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.35 131.77 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 54.92 71.0 1.4 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.067 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.69 83.35 1.57 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.493 2.128 . . . . 0.0 112.352 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.23 108.89 2.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.811 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.6 m -92.95 133.28 34.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -92.3 30.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.646 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.471 HG22 ' N ' ' A' ' 48' ' ' GLN . 11.0 p -90.14 148.16 4.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.194 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.471 ' N ' HG22 ' A' ' 47' ' ' VAL . 2.6 mt-30 -71.55 -165.69 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -74.42 -20.51 79.58 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.54 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -89.97 113.1 24.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 110.947 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.536 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -82.17 -50.27 0.83 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 37.9 Cg_endo -66.46 147.93 83.2 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.03 1.82 . . . . 0.0 112.491 -179.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.7 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -76.65 138.39 40.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.591 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.848 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.88 179.14 5.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.709 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.608 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -48.39 -40.23 25.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.524 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.863 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 70.7 m -58.55 -47.96 82.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.975 0.417 . . . . 0.0 110.538 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.863 ' HE2' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.14 -42.93 86.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.179 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.608 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.1 OUTLIER -59.64 -45.33 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.809 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.92 -12.16 34.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.338 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 m -76.46 -11.41 59.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.313 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.646 ' CB ' ' HG2' ' A' ' 65' ' ' GLU . . . -139.14 61.01 18.96 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.406 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.491 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 71.2 Cg_endo -100.47 124.03 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.217 2.612 . . . . 0.0 112.813 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 71.2 Cg_endo -98.03 30.76 12.73 Favored 'Cis proline' 0 N--CA 1.456 -0.698 0 C-N-CA 124.365 -1.098 . . . . 0.0 112.218 -0.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.558 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 46.9 mm-40 -52.78 -85.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.574 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 1.014 ' HG3' ' HG2' ' A' ' 69' ' ' MET . 6.7 pt-20 -106.63 28.37 7.94 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.171 0.51 . . . . 0.0 110.583 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.464 ' C ' HD21 ' A' ' 70' ' ' LEU . 1.9 mt-30 -68.09 -18.51 64.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.348 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.477 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.89 28.79 4.49 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.714 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -131.92 -58.76 0.96 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.077 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 1.014 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -80.7 24.13 0.49 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.614 ' HB3' HD23 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -87.84 -42.61 12.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.39 0.614 . . . . 0.0 109.717 178.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.671 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -118.77 11.93 11.98 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.057 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -125.67 3.1 7.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.735 -0.232 . . . . 0.0 111.517 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.742 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.16 -33.02 2.68 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.957 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.816 ' HB2' HG23 ' A' ' 90' ' ' THR . 2.6 mm? -56.84 -32.8 66.13 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.865 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 4.8 t80 -34.13 -62.58 0.37 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -173.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.865 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.9 Cg_exo -64.25 -17.96 61.58 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.906 1.737 . . . . 0.0 112.281 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.7 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.1 mt -98.53 -18.62 18.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.901 -0.591 . . . . 0.0 112.276 -177.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 74' ' ' LEU . 8.7 mm -72.73 -46.44 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.937 0.399 . . . . 0.0 110.492 179.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.559 ' HG2' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -52.65 -17.34 1.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.178 178.5 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.61 -37.41 36.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.712 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.469 ' HE2' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -74.31 -49.27 23.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.813 -179.321 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.686 ' ND1' HG13 ' A' ' 119' ' ' VAL . 1.9 m-70 -107.72 159.39 30.54 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.418 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.618 ' HD2' HD13 ' A' ' 85' ' ' LEU . 19.9 Cg_exo -65.39 72.17 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.524 2.15 . . . . 0.0 111.904 179.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.559 HG23 ' HG2' ' A' ' 79' ' ' GLN . 1.6 m 49.03 39.44 14.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.933 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.618 HD13 ' HD2' ' A' ' 83' ' ' PRO . 14.9 mt -95.83 9.15 41.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.276 -179.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.599 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.11 -140.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.718 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.438 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.27 -12.66 30.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.581 -0.819 . . . . 0.0 111.897 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.0 OUTLIER -156.63 -23.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.707 HG21 HG13 ' A' ' 115' ' ' VAL . 56.9 mt -50.33 -84.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.227 -0.115 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.816 HG23 ' HB2' ' A' ' 74' ' ' LEU . 0.4 OUTLIER -55.34 -36.84 66.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.674 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.03 -29.23 59.16 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.681 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.4 ttp -76.45 -35.65 58.36 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.019 -0.591 . . . . 0.0 109.672 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.61 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.6 mm? -58.62 -6.93 0.81 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.72 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.626 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 mm? -108.14 27.17 9.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -170.78 3.21 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.334 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.886 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -151.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.346 0.593 . . . . 0.0 111.691 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.561 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.57 -2.59 0.36 Allowed 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.092 177.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 71.1 m-20 78.16 -27.84 0.16 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.377 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -31.5 60.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.001 0.429 . . . . 0.0 110.008 178.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.886 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.1 mt-10 -75.32 -23.71 57.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.786 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.634 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.6 OUTLIER -75.04 -23.63 58.15 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.862 177.06 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.4 mp -92.47 -42.45 9.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.266 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.53 -39.55 85.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.273 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.907 ' HE3' HD23 ' A' ' 111' ' ' LEU . 6.3 ptm -57.68 -33.61 68.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.614 HD23 ' HB3' ' A' ' 70' ' ' LEU . 12.6 mt -87.15 -10.54 52.46 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.917 -179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -8.1 14.52 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -177.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.683 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -139.9 132.64 15.04 Favored Pre-proline 0 C--N 1.33 -0.263 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.883 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.461 ' O ' HG23 ' A' ' 54' ' ' THR . 61.1 Cg_endo -72.03 4.56 3.15 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.663 2.242 . . . . 0.0 112.03 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 113' ' ' SER . 65.4 mt-10 -127.3 -13.09 5.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.494 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.683 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.51 -46.91 20.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.907 HD23 ' HE3' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.93 -40.7 14.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.434 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 0.8 OUTLIER -83.58 -66.1 0.93 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.682 -179.253 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 3.9 m -47.06 -47.7 22.58 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.737 0.304 . . . . 0.0 111.429 -178.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 118' ' ' ALA . 9.4 mmtt -64.69 -33.47 76.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.707 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -69.16 -55.05 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.614 ' HA ' HG22 ' A' ' 119' ' ' VAL . 3.3 t70 -54.04 -38.16 64.91 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.95 0.405 . . . . 0.0 110.456 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -75.2 -31.19 60.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.128 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -70.77 -21.21 62.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.946 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.686 HG13 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -67.77 -48.78 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.581 0 N-CA-C 109.479 -0.564 . . . . 0.0 109.479 176.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.6 -22.65 56.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.101 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 43.1 t -86.46 -33.99 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.46 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.556 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.97 -38.68 72.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.606 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -69.67 -28.85 66.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.907 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.69 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -88.7 -6.36 57.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.97 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.517 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 2.5 t-80 -115.59 -5.53 12.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.288 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 122' ' ' LEU . 6.6 mm100 -69.04 -104.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.953 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.33 31.16 2.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.693 0.283 . . . . 0.0 111.105 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.69 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 1.5 mttm -93.5 -157.02 0.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.261 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.66 24.08 1.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.727 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -86.73 36.8 0.72 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.307 -179.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.68 -10.76 49.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -88.78 164.64 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.859 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -22.59 21.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.999 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -81.99 134.49 35.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.101 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.7 m -104.33 133.88 47.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.079 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -92.55 159.87 15.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.95 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 3.4 t -99.4 -73.72 0.62 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.951 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -79.23 154.73 28.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.5 t -97.94 -35.68 10.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -91.03 56.99 3.28 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.479 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.604 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 3.9 t -96.06 -51.97 0.23 Allowed Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.431 0.16 . . . . 0.0 111.431 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.604 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 22.9 Cg_exo -65.27 -177.0 0.56 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.32 2.013 . . . . 0.0 112.183 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 p -83.69 68.94 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.074 -179.922 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 112.401 -0.28 . . . . 0.0 112.401 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -61.29 162.26 20.76 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.585 2.19 . . . . 0.0 112.201 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.88 146.47 26.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -97.3 136.87 12.99 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.393 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 147.4 24.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.773 0.32 . . . . 0.0 110.911 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.42 60.14 3.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.04 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.23 11.33 21.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -156.69 40.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.933 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 61.16 179.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.182 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.4 ' HA ' ' C ' ' A' ' 11' ' ' PRO . 23.6 p -135.13 135.39 22.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.828 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.4 ' C ' ' HA ' ' A' ' 10' ' ' THR . 12.7 Cg_exo -70.73 141.9 70.22 Favored 'Cis proline' 0 C--N 1.349 0.563 0 C-N-CA 123.847 -1.314 . . . . 0.0 112.416 0.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.22 -21.11 46.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.24 133.59 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.951 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 14' ' ' ARG . 21.8 mtp180 -86.56 -60.01 2.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.966 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.48 126.49 45.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.074 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.0 t -115.93 115.61 40.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.78 113.12 1.28 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.55 2.167 . . . . 0.0 112.277 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.22 -164.08 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.851 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -60.69 123.66 18.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HZ1' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -88.79 179.74 6.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.77 55.84 3.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.63 85.45 6.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.032 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.67 10.51 15.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.108 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.71 -66.46 1.67 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.363 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.3 p -105.8 126.51 61.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.919 0.39 . . . . 0.0 110.901 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 100.11 11.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.873 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.71 106.61 41.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.21 -70.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.549 2.166 . . . . 0.0 112.269 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -88.52 64.3 7.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -76.73 -72.48 0.34 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -156.93 -5.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.87 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 tp -72.49 113.79 9.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.73 -22.61 15.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.26 110.78 18.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.45 122.85 70.46 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.941 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.37 -154.3 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.449 2.099 . . . . 0.0 112.143 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -79.87 116.49 20.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.4 m -79.26 -13.79 13.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.972 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.97 127.03 33.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.887 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.13 140.57 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.401 ' H ' ' HG2' ' A' ' 41' ' ' GLN . 4.1 pt20 -106.59 125.44 51.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.822 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.423 ' HB2' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -64.4 -51.83 57.75 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.464 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.423 ' HD3' ' HB2' ' A' ' 42' ' ' GLN . 19.9 Cg_exo -66.28 -169.6 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.19 1.927 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.94 175.34 3.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.996 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.475 HG13 ' N ' ' A' ' 46' ' ' HIS . 11.8 p -101.53 -29.89 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.475 ' N ' HG13 ' A' ' 45' ' ' VAL . 1.9 p-80 -101.03 -173.51 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.645 ' HB ' ' HB2' ' A' ' 50' ' ' GLN . 2.9 t -94.01 146.22 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.085 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.87 -26.62 23.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.963 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -94.51 -18.2 36.48 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.623 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.645 ' HB2' ' HB ' ' A' ' 47' ' ' VAL . 11.9 mt-30 -102.31 52.75 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.871 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -70.66 127.89 91.49 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.839 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.58 -175.12 1.24 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.503 2.136 . . . . 0.0 112.31 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -91.01 148.38 22.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.015 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.535 ' HA ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.56 -165.5 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.2 179.321 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.562 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -55.93 -38.21 69.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -60.09 -47.19 86.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.51 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.726 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.17 -43.78 87.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.178 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -57.24 -48.68 78.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.545 178.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.14 -3.58 20.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.427 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 36.2 t -88.26 -7.48 56.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.612 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -135.43 53.67 9.12 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.665 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.612 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 80.9 Cg_endo -103.69 114.09 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.148 2.566 . . . . 0.0 113.227 -178.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 91.6 Cg_endo -100.25 133.26 2.11 Favored 'Cis proline' 0 N--CA 1.456 -0.714 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.381 -0.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.497 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 0.6 OUTLIER -174.63 -85.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 179.793 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.712 ' HB3' ' HG2' ' A' ' 69' ' ' MET . 5.7 mm-40 -94.23 -0.93 54.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.959 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -52.99 -49.73 65.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.222 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -105.26 36.51 2.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.51 178.507 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.669 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 5.9 tp60 -136.06 -63.56 0.64 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.032 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.712 ' HG2' ' HB3' ' A' ' 65' ' ' GLU . 3.3 ptt? -81.44 22.53 0.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.856 ' HG ' HD21 ' A' ' 94' ' ' LEU . 1.2 pt? -79.83 -43.47 22.32 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.889 -0.325 . . . . 0.0 111.18 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.792 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -140.49 31.84 2.2 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.331 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -140.66 -7.83 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.653 0.263 . . . . 0.0 111.241 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.57 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.27 -14.36 5.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.617 ' HB2' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -75.48 -15.61 60.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.212 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -47.29 -56.27 13.05 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.781 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 34.8 Cg_exo -60.35 -11.94 18.38 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.04 1.826 . . . . 0.0 112.272 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.535 HD22 ' HA ' ' A' ' 74' ' ' LEU . 1.7 mm? -98.47 -29.05 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.65 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.755 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.2 mm -65.47 -38.11 81.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 120.773 0.321 . . . . 0.0 111.185 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.916 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 20.2 mt-30 -52.02 -17.72 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.578 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.7 -37.25 22.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.276 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.755 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.24 -35.72 61.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.068 0.461 . . . . 0.0 110.682 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.742 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -126.08 155.84 72.86 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.696 -179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -62.37 74.32 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.493 2.129 . . . . 0.0 111.854 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.916 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.2 p 48.37 31.4 2.72 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.987 -178.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -83.67 4.97 26.26 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.17 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -67.89 -138.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.878 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.24 -16.4 23.41 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.667 -0.777 . . . . 0.0 111.683 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.89 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.7 ttpt -156.02 -20.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.613 HD13 ' HA ' ' A' ' 86' ' ' ALA . 60.0 mt -50.35 -81.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.792 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.27 -39.79 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.513 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.96 -28.11 60.43 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 176.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.89 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.6 ttm -76.71 -38.1 54.94 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.41 0.624 . . . . 0.0 109.617 176.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.746 ' HG ' HG21 ' A' ' 115' ' ' VAL . 4.6 mm? -57.85 -5.82 0.46 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.334 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.856 HD21 ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.6 27.37 9.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.569 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -170.14 1.29 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.211 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.18 -152.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.402 0.62 . . . . 0.0 111.654 -179.793 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.432 ' N ' HG12 ' A' ' 96' ' ' ILE . 1.8 t70 -59.58 -3.22 0.44 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.058 177.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.586 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.15 -34.91 0.16 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 123.733 0.645 . . . . 0.0 111.234 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.414 ' H ' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -67.37 -29.18 68.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.938 178.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -79.67 -26.23 41.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.802 177.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -74.82 -27.17 60.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.618 176.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.88 -46.87 10.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.301 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.9 -39.94 87.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.118 -178.648 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.743 ' HE3' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -56.52 -34.13 66.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.521 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.569 ' N ' ' HG3' ' A' ' 104' ' ' MET . 23.0 mt -85.67 -12.98 49.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.506 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -107.8 -2.05 20.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.37 -177.323 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -150.07 132.64 8.14 Favored Pre-proline 0 CA--C 1.53 0.207 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.6 Cg_exo -68.48 -1.66 7.8 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.933 2.422 . . . . 0.0 112.139 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -116.96 -29.38 6.01 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.057 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -62.11 -42.19 98.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.203 -178.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.743 ' HG ' ' HE3' ' A' ' 104' ' ' MET . 4.8 tt -59.77 -25.39 64.86 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.669 -0.413 . . . . 0.0 111.176 179.303 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.414 ' HG2' ' HE1' ' A' ' 81' ' ' MET . 38.7 mtp180 -95.92 -66.09 0.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.923 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.505 ' OG ' ' HG3' ' A' ' 109' ' ' GLU . 1.5 m -42.82 -33.99 0.86 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.961 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.526 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 38.7 mmtt -81.77 -43.26 18.6 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.144 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.746 HG21 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -60.19 -58.4 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.46 -41.75 53.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.19 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -73.17 -31.07 64.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.066 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -68.29 -27.71 66.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.63 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.742 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.4 t -59.41 -53.15 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.611 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.413 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -54.27 -23.68 15.88 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.065 177.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 121' ' ' VAL . 12.3 t -86.71 -30.96 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.65 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.791 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.51 -41.18 61.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.208 179.059 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.521 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -70.17 -28.71 65.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.401 0.62 . . . . 0.0 110.078 179.156 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.511 ' O ' ' HA ' ' A' ' 128' ' ' LYS . . . -76.78 -34.14 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.649 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.436 ' HA ' ' HG2' ' A' ' 128' ' ' LYS . 0.6 OUTLIER -88.43 -48.3 7.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.411 -178.459 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.651 ' HG3' HD13 ' A' ' 122' ' ' LEU . 7.8 mm-40 -56.92 -60.8 3.05 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.77 68.86 2.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.507 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -63.25 102.8 0.43 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.255 0.55 . . . . 0.0 111.977 -176.28 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.47 7.79 27.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.231 -0.895 . . . . 0.0 108.887 175.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -86.54 -5.34 59.17 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.428 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.0 97.5 0.37 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.935 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -98.7 -68.62 0.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.152 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -85.07 51.55 2.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.936 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -86.84 55.87 3.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.158 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.6 p -98.79 -18.7 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.933 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 45.8 p-10 -85.45 8.39 19.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.941 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.1 m -82.53 86.91 6.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.929 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.52 -42.13 83.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.018 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.7 p -98.88 132.23 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.45 -78.32 1.41 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.474 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.5 t -85.74 111.84 40.53 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.198 . . . . 0.0 111.091 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.63 -29.61 85.91 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.551 2.167 . . . . 0.0 112.373 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.9 p -85.6 45.24 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.932 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . 0.44 ' OXT' HG12 ' A' ' 144' ' ' VAL . 3.5 p . . . . . 0 C--O 1.25 1.088 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.63 -59.51 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.638 2.225 . . . . 0.0 112.235 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -97.09 13.67 28.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.5 112.22 3.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.497 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.4 t -95.15 -52.8 4.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.877 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.84 128.65 13.36 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.997 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 56.21 42.71 27.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.144 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.52 27.76 0.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.044 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -101.32 95.7 6.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.178 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 65.2 p 46.62 72.0 1.4 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.363 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -62.98 113.82 2.17 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.602 2.201 . . . . 0.0 112.145 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -20.74 35.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.062 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.0 t -89.13 110.63 21.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.16 168.6 17.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.946 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -91.53 160.75 15.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.413 HG11 ' HB2' ' A' ' 18' ' ' GLN . 1.7 t -103.76 110.81 64.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -67.58 -12.69 36.51 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.437 2.091 . . . . 0.0 112.269 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.413 ' HB2' HG11 ' A' ' 16' ' ' VAL . 17.0 mt-30 -73.62 108.53 6.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.857 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -76.41 124.22 27.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.956 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.23 103.39 14.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.17 123.03 18.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.53 -48.54 69.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.014 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 156.07 33.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.037 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.05 17.2 57.48 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.475 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.2 m -105.57 145.43 13.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.96 -156.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.797 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -69.54 114.81 26.99 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.729 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -57.0 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.547 2.165 . . . . 0.0 112.383 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -89.56 113.74 25.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.967 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -94.74 139.63 30.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -7.7 59.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.041 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 tp -86.22 69.72 10.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.829 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.34 132.18 49.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.01 -4.32 52.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.169 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -87.79 152.33 51.23 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.84 154.33 13.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.533 2.155 . . . . 0.0 112.42 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.4 137.5 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.846 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.2 p -102.5 149.38 7.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.03 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.57 174.64 6.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.998 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.9 mmt -84.89 -169.82 2.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.831 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -116.78 56.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.832 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 55.94 82.75 0.24 Allowed Pre-proline 0 C--N 1.332 -0.174 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.965 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.17 179.77 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.519 2.146 . . . . 0.0 112.356 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.63 101.85 0.66 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.204 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 4.8 m -92.61 142.78 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.046 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -85.72 98.61 10.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.2 t -94.83 144.62 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -71.26 -53.28 14.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.093 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.25 176.07 40.04 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.557 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 93.54 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 110.901 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -82.35 132.07 53.93 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.981 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.39 -175.64 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.598 2.199 . . . . 0.0 112.354 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.804 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -82.68 149.35 27.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.855 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -167.52 -175.42 2.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.305 179.401 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.14 -34.14 21.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.278 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 20.0 m -64.01 -44.79 91.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.627 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.804 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.25 -42.04 97.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.207 178.858 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.567 HD23 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -61.88 -44.5 96.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.759 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.71 -12.41 58.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.292 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.2 m -76.92 -16.77 59.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.592 ' HB3' ' HB2' ' A' ' 64' ' ' GLN . . . -134.51 60.58 43.75 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.059 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.764 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.2 Cg_exo -53.1 -51.8 10.23 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.549 2.166 . . . . 0.0 113.102 -179.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 65.9 Cg_endo -95.85 21.53 0.45 Allowed 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.582 2.188 . . . . 0.0 112.536 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.592 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 20.4 mm100 -127.1 -94.03 0.46 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.654 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.571 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -105.44 27.72 8.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.665 -177.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.764 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -59.04 -43.03 91.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.861 0.362 . . . . 0.0 110.676 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.572 ' HA ' HD23 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -117.29 41.33 2.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.743 179.339 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.487 ' C ' HD13 ' A' ' 70' ' ' LEU . 2.0 mt-30 -136.46 -54.66 0.74 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.281 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.571 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.3 ptt? -80.54 -1.84 43.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.784 -178.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.572 HD23 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -61.81 -43.12 99.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.591 0.234 . . . . 0.0 111.559 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.832 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -130.48 28.24 3.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.349 -0.929 . . . . 0.0 112.684 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -140.91 -2.97 1.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 0.0 111.194 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.573 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.35 -23.1 3.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.059 0.457 . . . . 0.0 110.721 -179.819 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.639 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.04 -22.47 59.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.812 -178.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.673 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -44.95 -56.35 9.08 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.968 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.673 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.1 Cg_exo -61.12 -15.14 37.65 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.031 1.821 . . . . 0.0 112.371 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.533 HD12 ' HB2' ' A' ' 53' ' ' LEU . 82.9 mt -98.64 -25.51 14.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.909 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.7 mm -65.23 -38.64 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-O 121.009 0.433 . . . . 0.0 110.667 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.692 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.0 mt-30 -53.64 -14.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.827 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.46 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -88.2 -30.46 19.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.189 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.488 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -84.0 -46.63 11.83 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -173.554 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.784 ' N ' ' HA ' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -80.64 -35.57 0.86 Allowed Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 -171.309 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.784 ' HA ' ' N ' ' A' ' 82' ' ' HIS . 42.1 Cg_endo -96.41 -76.24 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.028 0 CA-C-N 120.65 1.268 . . . . 0.0 112.675 2.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.692 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.9 m -68.08 76.46 0.23 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.696 -178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -145.68 10.33 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.43 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -76.79 42.43 0.3 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.448 -177.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -12.59 64.28 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.045 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.775 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.8 ttpt 177.04 36.9 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.042 0.449 . . . . 0.0 110.091 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.732 HG23 HG21 ' A' ' 119' ' ' VAL . 67.4 mt -79.72 -90.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.169 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.832 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.3 -39.62 57.27 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.26 -32.17 57.1 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.02 -1.085 . . . . 0.0 110.838 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.775 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.69 -25.57 32.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.367 178.637 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.649 HD22 ' O ' ' A' ' 89' ' ' ILE . 4.3 mm? -59.6 -7.92 1.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.732 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.567 HD23 HD12 ' A' ' 70' ' ' LEU . 1.8 mm? -106.19 27.33 8.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.5 pt-20 -166.43 1.53 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.463 -178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.953 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.83 -151.48 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.384 0.611 . . . . 0.0 111.73 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.526 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.2 t0 -59.08 -3.83 0.42 Allowed 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.085 178.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.547 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-80 79.55 -29.03 0.14 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.544 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -32.6 61.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.168 0.509 . . . . 0.0 109.827 178.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.953 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.8 mt-10 -74.08 -23.49 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.999 177.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 1.5 tp -74.86 -25.64 59.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.863 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -88.27 -47.05 8.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.239 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.4 OUTLIER -63.12 -41.26 99.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.055 -178.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.749 ' HE2' HD22 ' A' ' 111' ' ' LEU . 0.6 OUTLIER -56.1 -34.0 65.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.348 -179.736 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.552 ' N ' ' HG3' ' A' ' 104' ' ' MET . 15.0 mt -87.15 -8.63 56.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.039 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 2.6 pt-20 -111.85 -7.98 14.15 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.42 131.7 14.08 Favored Pre-proline 0 C--N 1.331 -0.196 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.782 -179.134 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.7 Cg_exo -67.58 1.2 3.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.808 2.339 . . . . 0.0 112.103 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -127.19 -11.69 5.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.5 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.671 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -75.24 -46.16 35.6 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.292 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.855 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.48 -29.83 3.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.653 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.457 ' HG2' ' HE2' ' A' ' 81' ' ' MET . 55.1 mtt180 -95.22 -64.06 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.076 -179.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.445 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 27.8 t -46.24 -31.56 2.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.967 0.413 . . . . 0.0 109.981 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 118' ' ' ALA . 15.8 mmtm -80.75 -41.05 24.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.88 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.481 HG13 ' CG2' ' A' ' 89' ' ' ILE . 1.5 t -64.38 -63.0 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.305 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.577 ' HA ' HG23 ' A' ' 119' ' ' VAL . 9.6 t70 -48.84 -40.07 27.97 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 111.081 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.0 -35.61 66.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.796 0.332 . . . . 0.0 110.454 179.49 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 114' ' ' LYS . . . -64.75 -26.28 68.29 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.834 178.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.732 HG21 HG23 ' A' ' 89' ' ' ILE . 12.9 t -63.79 -47.76 89.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.141 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -55.44 -25.58 37.09 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.455 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.447 HG12 ' HE2' ' A' ' 92' ' ' MET . 3.8 t -87.13 -34.54 7.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.062 177.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.509 ' CD1' ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -65.58 -33.56 76.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.335 178.209 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.402 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -79.82 -24.76 41.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.703 177.685 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.58 ' O ' ' HB1' ' A' ' 130' ' ' ALA . . . -88.62 5.94 40.57 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.794 178.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -127.45 -27.62 2.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.994 0.426 . . . . 0.0 110.137 178.059 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -87.91 -38.69 15.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.309 178.459 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.402 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -95.36 -52.36 4.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.96 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.547 ' HG2' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.19 167.94 10.9 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.624 0.726 . . . . 0.0 111.094 179.69 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.1 86.08 6.81 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.571 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.58 ' HB1' ' O ' ' A' ' 124' ' ' ALA . . . -57.44 -62.37 1.83 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.138 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -86.15 149.81 24.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -98.61 51.85 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.908 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -68.39 -50.51 52.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -90.77 75.91 6.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.96 146.42 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.049 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -62.78 144.04 56.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.789 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.7 m -91.1 62.41 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.77 160.82 31.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.167 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.5 t -99.47 -21.66 15.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.874 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -84.44 173.84 50.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.466 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.43 125.03 89.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.698 0.285 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.6 142.18 25.8 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.513 2.142 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -16.72 38.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.053 179.959 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.167 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.85 -77.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.53 2.153 . . . . 0.0 112.348 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.7 -1.59 37.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.943 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.44 157.71 22.59 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.392 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.26 161.32 15.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 110.964 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.28 82.08 3.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.085 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -161.57 -54.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.61 -38.56 54.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.945 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -163.14 169.83 18.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.99 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.1 m 56.32 90.87 0.08 OUTLIER Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.093 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.36 154.36 64.28 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.575 2.183 . . . . 0.0 112.205 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.99 34.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.8 t -100.29 147.28 7.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.018 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.6 mtt-85 -96.48 114.06 25.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.988 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.48 140.95 29.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.412 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 5.5 m -90.89 139.99 26.12 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 31.5 Cg_exo -59.66 -57.98 0.71 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.599 2.199 . . . . 0.0 112.173 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -89.03 151.83 22.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -75.06 -17.22 60.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.94 121.0 21.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -69.01 126.48 29.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.987 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.67 -162.65 0.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.002 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.63 99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.002 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.59 7.22 77.57 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.528 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 t -91.57 -41.83 13.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.5 mtt180 -71.08 102.54 2.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.442 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 73.2 m-20 -76.03 -51.83 2.72 Favored Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.383 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' A' ' 27' ' ' ASN . 72.0 Cg_endo -76.92 101.58 1.52 Allowed 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.119 1.879 . . . . 0.0 112.349 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -74.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -99.39 -18.28 17.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.757 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 55.25 39.61 31.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.013 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.84 91.87 8.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -91.47 -177.5 4.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.5 -2.19 30.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -81.05 152.06 70.92 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.09 50.19 3.45 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.725 2.284 . . . . 0.0 112.526 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -86.57 50.28 1.97 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.985 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -79.23 123.29 35.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.6 t -99.15 -12.44 20.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.939 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 9.6 ttt -100.98 92.12 4.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.083 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -148.47 137.55 21.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.706 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.669 ' N ' ' HA ' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -59.86 -50.64 85.64 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.533 -179.732 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.669 ' HA ' ' N ' ' A' ' 42' ' ' GLN . 67.7 Cg_endo -90.67 179.47 13.87 Favored 'Cis proline' 0 C--N 1.356 0.93 0 C-N-CA 124.599 -1.001 . . . . 0.0 112.503 0.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.96 132.74 53.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.093 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 m -80.83 133.76 28.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -98.48 -6.55 30.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.965 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 30.9 m -86.2 166.89 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.063 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -97.58 68.82 2.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.995 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -83.2 -71.36 1.32 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.472 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.96 157.57 18.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.737 0.303 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.653 ' N ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -77.98 -52.01 1.63 Allowed Pre-proline 0 CA--C 1.535 0.385 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.294 179.684 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.653 ' HA ' ' N ' ' A' ' 51' ' ' GLU . 95.4 Cg_endo -92.37 -41.34 0.28 Allowed 'Cis proline' 0 C--N 1.355 0.89 0 C-N-CA 124.657 -0.976 . . . . 0.0 112.884 0.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.828 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -74.53 141.28 44.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 111.186 -179.671 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.863 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.95 -168.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.331 179.308 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.542 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -54.79 -38.91 67.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.507 -179.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.467 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 1.2 m -60.42 -45.92 91.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 0.0 110.419 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.828 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.49 -43.14 88.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.065 178.688 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.542 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.15 -48.16 81.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.476 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.01 -2.6 15.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.355 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.445 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 27.7 t -88.99 -6.98 56.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.315 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.647 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.6 50.82 5.77 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.647 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 80.7 Cg_endo -103.06 121.71 0.07 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 123.016 2.477 . . . . 0.0 112.892 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.452 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 90.4 Cg_endo -100.26 124.96 1.48 Allowed 'Cis proline' 0 N--CA 1.455 -0.784 0 C-N-CA 124.51 -1.038 . . . . 0.0 112.41 0.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -168.26 -87.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.729 0.3 . . . . 0.0 111.134 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.531 ' HA ' ' HB3' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -96.15 6.89 47.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.857 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.0 -37.87 61.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.665 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -120.58 30.34 6.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.804 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.531 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 8.8 tt0 -131.69 -53.6 1.0 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.437 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.511 ' SD ' HD23 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -77.26 2.4 15.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.674 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.665 HD12 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -68.4 -39.49 81.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.611 -179.759 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.829 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -136.4 27.76 2.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.591 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -139.59 -10.16 1.22 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.618 0.247 . . . . 0.0 111.27 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.562 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.9 tmt_? -127.35 -14.82 5.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.307 . . . . 0.0 110.774 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.846 HD12 HD12 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.77 -14.63 59.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.484 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.642 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 5.6 t80 -49.39 -55.03 24.35 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.531 -178.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.4 Cg_exo -61.69 -9.35 13.51 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.083 1.855 . . . . 0.0 112.455 -179.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.572 HD22 HD11 ' A' ' 53' ' ' LEU . 1.8 mm? -98.69 -35.41 10.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.699 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.716 HG22 HD11 ' A' ' 89' ' ' ILE . 4.7 mm -60.09 -40.72 84.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.855 0.359 . . . . 0.0 110.601 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.749 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.2 mt-30 -49.19 -19.16 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.879 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.63 -41.63 17.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.908 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.624 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -70.31 -38.72 75.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.331 0.586 . . . . 0.0 110.412 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.517 ' CE1' ' CG2' ' A' ' 119' ' ' VAL . 5.3 m170 -121.71 148.69 51.37 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.442 -177.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.621 ' HD2' HD13 ' A' ' 85' ' ' LEU . 37.8 Cg_exo -60.33 74.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.441 2.094 . . . . 0.0 111.699 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.749 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.7 OUTLIER 48.83 28.33 1.88 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.643 -178.048 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.621 HD13 ' HD2' ' A' ' 83' ' ' PRO . 3.1 mt -80.69 2.41 26.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.146 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.626 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.05 -131.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.585 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.58 -18.55 6.97 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.045 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.835 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.3 ttpt -156.34 -20.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.781 HD13 HG21 ' A' ' 119' ' ' VAL . 70.1 mt -49.81 -79.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.829 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.78 -40.14 69.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.457 0.17 . . . . 0.0 110.824 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.33 -28.39 61.79 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.097 -1.049 . . . . 0.0 110.57 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.835 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.0 ttm -76.12 -36.69 58.72 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.581 0.705 . . . . 0.0 109.79 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.652 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.4 mm? -56.27 -9.47 0.67 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.619 -178.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.778 HD13 HD22 ' A' ' 101' ' ' LEU . 2.4 mm? -106.32 28.34 7.84 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 176.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -170.26 0.35 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.662 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.966 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.88 -148.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.464 0.65 . . . . 0.0 111.493 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.602 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -53.92 -10.14 0.3 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.99 176.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.688 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.5 m-80 79.87 -22.95 0.25 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.099 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -32.35 59.38 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.966 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -70.48 -29.89 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.864 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.778 HD22 HD13 ' A' ' 94' ' ' LEU . 2.2 tm? -69.36 -27.31 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.197 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.4 mp -87.96 -46.58 9.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.348 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.446 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.12 -39.83 90.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.567 -177.821 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.916 ' HE1' HD21 ' A' ' 111' ' ' LEU . 7.3 ptm -57.19 -35.87 70.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.715 0.293 . . . . 0.0 111.122 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 58' ' ' LEU . 12.5 mt -85.7 -10.09 56.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.9 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -109.55 -8.51 14.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.175 -177.515 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.695 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -140.31 131.49 14.12 Favored Pre-proline 0 C--N 1.33 -0.276 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.865 -178.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 14.9 Cg_exo -69.14 2.4 3.21 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.978 2.452 . . . . 0.0 112.029 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -127.3 -11.99 5.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.671 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.695 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -77.16 -45.57 26.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.916 HD21 ' HE1' ' A' ' 104' ' ' MET . 0.3 OUTLIER -46.64 -41.21 14.37 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.779 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.624 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 0.3 OUTLIER -80.6 -63.27 1.45 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.296 179.771 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -48.71 -55.11 12.31 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.348 . . . . 0.0 111.076 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.819 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 17.9 mmtt -57.6 -31.28 66.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.652 HG23 ' HG ' ' A' ' 93' ' ' LEU . 1.4 t -70.36 -58.63 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.66 ' HA ' HG22 ' A' ' 119' ' ' VAL . 23.3 t70 -49.62 -38.92 33.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.285 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -43.99 68.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.187 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.416 ' O ' ' HE3' ' A' ' 92' ' ' MET . . . -58.4 -29.05 65.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.936 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.781 HG21 HD13 ' A' ' 89' ' ' ILE . 21.6 t -56.91 -51.5 67.4 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.789 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.02 -26.91 28.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.92 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 121' ' ' VAL . 9.2 t -86.18 -31.03 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.875 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.754 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.92 -40.71 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.908 179.259 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.444 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 16.9 mm100 -61.97 -37.91 86.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.653 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.495 ' C ' ' HG2' ' A' ' 128' ' ' LYS . . . -67.49 -79.87 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.235 176.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.446 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.6 OUTLIER -32.62 -36.13 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.705 0.628 . . . . 0.0 112.328 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 124' ' ' ALA . 12.4 mm100 -66.94 -78.33 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.303 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.46 26.55 4.31 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.742 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 1.2 ptpt -96.54 -161.62 0.89 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 111.122 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -87.93 26.59 1.32 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.674 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.742 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.28 -71.21 0.12 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.328 -177.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -81.14 -173.67 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -92.37 -69.95 0.72 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.993 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.83 -164.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.947 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.99 176.31 1.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.168 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.6 m -97.31 80.98 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.121 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -92.55 10.04 32.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.962 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.4 t -96.34 82.43 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -83.64 -72.01 0.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.14 -17.16 11.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -102.12 111.82 4.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.351 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 1.6 m -101.94 101.44 18.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.728 0.299 . . . . 0.0 111.187 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.81 -172.1 1.14 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.563 2.175 . . . . 0.0 112.316 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 p -83.87 -179.72 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.818 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.083 -179.909 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.436 -0.266 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.33 40.35 0.96 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.714 2.276 . . . . 0.0 112.435 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.05 141.99 41.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.58 164.92 28.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.505 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.5 p -101.26 -20.27 15.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.799 0.333 . . . . 0.0 110.984 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -128.33 1.93 5.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -92.33 -165.94 1.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.037 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.78 134.55 57.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -123.1 -18.56 6.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 48.6 p -92.96 141.38 24.08 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.009 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.43 108.95 2.63 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.512 2.141 . . . . 0.0 112.411 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.42 -30.71 21.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -104.18 143.15 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.071 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.8 mtt85 -71.67 119.13 15.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.977 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 p -111.27 117.35 32.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.602 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 t -88.29 -51.34 0.4 Allowed Pre-proline 0 CA--C 1.532 0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.496 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.602 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 31.5 Cg_exo -59.34 121.91 10.68 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.198 1.932 . . . . 0.0 112.239 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -72.91 -178.71 2.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -75.02 81.93 2.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.923 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.52 161.35 13.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.54 -175.7 5.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -89.79 -62.22 1.52 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.065 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.522 ' HB3' HG21 ' A' ' 25' ' ' VAL . . . -65.49 165.53 11.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.174 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.98 42.87 3.19 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 23' ' ' ALA . 3.2 t -98.93 132.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.328 . . . . 0.0 111.071 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -93.27 112.01 23.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -83.88 110.25 24.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.65 81.1 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.47 2.113 . . . . 0.0 112.288 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -95.58 69.88 3.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.07 162.99 28.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -107.3 66.35 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.87 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.23 -37.11 11.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.965 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -77.38 -27.83 52.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.94 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.99 92.25 8.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -98.17 137.05 20.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.439 ' HB2' ' H ' ' A' ' 37' ' ' GLN . 73.8 Cg_endo -75.4 -153.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.52 2.146 . . . . 0.0 112.228 179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.439 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 0.7 OUTLIER -93.37 60.25 3.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.871 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -103.48 38.31 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.962 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 m -82.46 -21.44 35.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.961 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.1 tpp -88.11 3.18 50.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.0 tp60 -165.45 100.98 0.71 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.009 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -147.55 137.95 12.66 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.08 122.57 11.66 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.645 2.23 . . . . 0.0 112.313 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.75 118.04 28.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.0 t -83.52 103.99 11.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -108.03 58.14 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.822 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.637 HG21 ' H ' ' A' ' 49' ' ' GLY . 11.0 p -89.11 146.33 6.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.021 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -90.16 -0.14 57.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.088 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.637 ' H ' HG21 ' A' ' 47' ' ' VAL . . . -89.24 17.83 49.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.493 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -97.18 172.93 7.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.86 0.362 . . . . 0.0 110.911 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -75.56 120.01 79.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.865 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.08 173.4 0.94 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.58 2.187 . . . . 0.0 112.309 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.802 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -80.77 143.78 32.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.85 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -164.64 -167.92 1.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.329 179.388 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.553 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -56.84 -37.44 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.093 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.649 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 5.1 m -61.12 -43.61 98.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.389 179.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.802 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -62.26 -41.49 98.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.149 178.55 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.553 HD23 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -59.25 -46.13 89.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.546 179.151 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.99 -12.17 61.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.3 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 28.5 t -76.37 -8.63 57.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.832 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.537 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -133.46 128.68 20.28 Favored Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.329 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.555 ' O ' ' N ' ' A' ' 64' ' ' GLN . 45.5 Cg_exo -55.0 -164.49 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 122.728 2.285 . . . . 0.0 110.698 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 62' ' ' PRO . 82.7 Cg_exo -42.75 -14.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.935 1.757 . . . . 0.0 112.53 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.555 ' N ' ' O ' ' A' ' 62' ' ' PRO . 11.4 mt-30 -39.4 -88.42 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.414 177.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.743 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -105.38 8.51 33.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.935 -179.459 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -57.98 -24.48 58.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.05 0.452 . . . . 0.0 110.772 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.586 ' HA ' HD13 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -130.32 25.08 5.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 179.62 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 40.7 tt0 -130.25 -58.02 1.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.92 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.743 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -74.0 18.02 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.823 HD11 HD22 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.41 -39.46 13.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.119 0.485 . . . . 0.0 110.491 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.962 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -130.74 16.41 5.34 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.198 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -133.84 -11.09 2.67 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.477 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.562 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.77 -14.05 5.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.843 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.82 -12.06 59.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.131 179.392 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.726 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.1 t80 -46.81 -54.29 20.66 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.024 -178.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.726 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.1 Cg_exo -62.67 -15.62 47.54 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.205 1.937 . . . . 0.0 112.286 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.676 HD21 HD12 ' A' ' 53' ' ' LEU . 2.2 mm? -93.25 -28.13 16.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.486 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.766 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.0 mm -70.61 -40.18 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.781 0.324 . . . . 0.0 111.187 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.784 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 17.8 mt-30 -53.29 -16.43 1.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.346 0.593 . . . . 0.0 110.22 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.83 -37.23 22.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.062 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.766 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.17 -35.96 61.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.046 0.45 . . . . 0.0 110.704 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.655 ' ND1' HG12 ' A' ' 119' ' ' VAL . 3.9 m-70 -125.24 161.98 46.7 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.861 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.796 ' HG2' HD11 ' A' ' 85' ' ' LEU . 45.7 Cg_endo -67.59 72.16 0.66 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.402 2.068 . . . . 0.0 112.041 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.784 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 66.1 p 46.83 41.89 11.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.356 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.796 HD11 ' HG2' ' A' ' 83' ' ' PRO . 2.3 mp -99.15 11.06 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -71.69 22.33 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.986 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.489 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.04 -17.15 35.74 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.657 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.634 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.3 ttpt -168.95 29.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.816 0.341 . . . . 0.0 111.06 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.629 HD12 HG21 ' A' ' 119' ' ' VAL . 67.5 mt -80.7 -90.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.07 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.962 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -52.04 -41.73 62.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.593 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.07 -32.31 49.64 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.113 -1.042 . . . . 0.0 111.146 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.634 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -85.69 -22.39 27.87 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 120.908 0.385 . . . . 0.0 110.45 179.437 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.624 HD23 ' O ' ' A' ' 89' ' ' ILE . 3.9 mm? -60.22 -10.01 4.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.195 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.619 HD22 ' HA3' ' A' ' 71' ' ' GLY . 2.2 mm? -102.91 26.43 8.13 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.3 pt-20 -165.5 -0.62 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.916 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.993 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.94 -151.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.397 0.618 . . . . 0.0 111.633 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.595 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.7 t0 -53.83 -10.05 0.28 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.151 176.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.718 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.8 OUTLIER 79.16 -23.03 0.26 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.191 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -76.53 -25.98 54.72 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.993 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -77.96 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.779 177.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.804 ' HG ' HD22 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.5 -21.41 66.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.865 178.094 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.804 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -88.68 -52.4 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.23 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.527 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.6 OUTLIER -63.36 -38.75 92.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.223 -178.56 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.693 ' HE2' HD23 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -56.85 -35.1 68.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.743 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.823 HD22 HD11 ' A' ' 70' ' ' LEU . 21.7 mt -86.89 -10.15 54.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.942 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.527 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.18 -4.64 15.65 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -177.029 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.803 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -141.93 130.0 11.81 Favored Pre-proline 0 C--N 1.332 -0.192 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.597 -179.918 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.47 6.25 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.402 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.439 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.4 OUTLIER -131.54 -24.25 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.538 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.803 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.13 -42.62 99.54 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.85 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.76 -28.55 2.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.357 175.706 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.9 mtp85 -95.89 -66.63 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.073 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 22.7 t -44.93 -30.36 0.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.306 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -80.79 -42.27 22.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.953 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.495 HG11 ' HE2' ' A' ' 81' ' ' MET . 1.9 t -64.25 -60.18 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.279 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.584 ' HA ' HG22 ' A' ' 119' ' ' VAL . 0.5 OUTLIER -51.31 -39.61 57.25 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.078 179.442 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' A' ' 113' ' ' SER . 2.1 mt-10 -73.21 -33.9 65.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.916 0.388 . . . . 0.0 110.151 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.577 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -67.08 -27.46 67.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.655 HG12 ' ND1' ' A' ' 82' ' ' HIS . 22.0 t -60.57 -47.46 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.05 -25.9 59.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.557 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.512 HG12 ' HE3' ' A' ' 92' ' ' MET . 5.1 t -86.56 -31.26 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.799 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.598 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.6 -40.08 66.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.927 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -64.02 -38.59 91.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.94 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.732 ' HB2' ' HE2' ' A' ' 128' ' ' LYS . . . -70.96 -77.72 0.08 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.396 177.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.3 OUTLIER -33.19 -34.58 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.725 0.641 . . . . 0.0 112.279 -178.237 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 124' ' ' ALA . 2.3 mt-30 -65.03 -80.76 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.271 179.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.48 25.82 4.81 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.732 ' HE2' ' HB2' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.18 -163.09 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.221 0.534 . . . . 0.0 111.054 179.128 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.92 29.41 0.93 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.706 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.676 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.73 -71.74 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.436 -177.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.06 169.84 16.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.242 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.29 45.26 1.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.963 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -60.66 -58.66 7.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.907 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -91.08 141.72 28.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.155 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.7 t -87.67 43.96 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.949 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -74.74 103.89 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.54 -169.77 2.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.881 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.47 132.86 51.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.094 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.439 ' HG1' ' HG2' ' A' ' 142' ' ' PRO . 0.0 OUTLIER -100.53 -162.71 0.96 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.86 -179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -101.31 -14.65 29.92 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.575 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.598 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 4.0 t -84.78 -50.89 0.56 Allowed Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.598 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 32.2 Cg_exo -59.47 -12.57 17.52 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.241 1.961 . . . . 0.0 112.468 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -74.92 0.21 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.874 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.095 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.74 158.55 56.6 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.576 2.184 . . . . 0.0 112.242 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -97.34 102.28 14.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.918 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.56 -80.55 1.54 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.609 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.8 m -85.31 -169.77 2.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.742 0.306 . . . . 0.0 110.922 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.6 -92.8 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.099 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.93 76.28 0.26 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.98 -33.07 0.34 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.073 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.83 13.28 14.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.057 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.474 ' HG1' HH21 ' A' ' 14' ' ' ARG . 0.0 OUTLIER -119.94 145.52 39.9 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.962 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.26 175.76 10.12 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.537 2.158 . . . . 0.0 112.28 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.49 -17.94 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.946 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.445 ' H ' HG21 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -101.95 82.62 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.028 179.839 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.474 HH21 ' HG1' ' A' ' 10' ' ' THR . 1.4 mtt85 -78.5 -13.69 59.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.8 p -110.48 163.56 13.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.4 m -102.74 125.63 35.14 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.091 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -56.65 -56.24 2.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.58 2.187 . . . . 0.0 112.343 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.29 148.53 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.038 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.86 172.08 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.985 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -77.19 167.0 22.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.873 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -84.8 104.39 14.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.931 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.89 -173.95 1.35 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.015 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.59 117.61 13.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.101 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.94 33.1 4.57 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.4 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.81 36.25 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-O 121.312 0.577 . . . . 0.0 110.831 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.512 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -73.45 -169.68 0.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.076 179.898 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.554 ' H ' ' HD2' ' A' ' 28' ' ' PRO . 1.5 m-20 -94.22 -51.17 0.25 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.661 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.554 ' HD2' ' H ' ' A' ' 27' ' ' ASN . 32.8 Cg_endo -63.65 115.4 3.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.129 1.886 . . . . 0.0 112.347 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -78.87 155.4 29.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.789 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.49 108.26 20.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.04 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 14.19 17.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.837 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.408 ' N ' HD23 ' A' ' 32' ' ' LEU . 4.2 mm? -79.01 -62.87 1.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -82.3 -75.75 0.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.86 120.11 15.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.071 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.483 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -86.34 -51.3 0.47 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.519 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 57.7 Cg_endo -71.01 129.27 16.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.149 1.899 . . . . 0.0 112.335 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -101.6 24.3 9.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.841 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.1 p -97.28 -9.7 8.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.099 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.54 -64.29 1.22 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.113 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.54 64.5 8.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.101 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -160.34 38.18 0.17 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.905 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -157.49 105.02 1.83 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.003 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.91 149.49 59.67 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.481 2.121 . . . . 0.0 112.274 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.48 109.39 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.111 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.467 ' H ' HG22 ' A' ' 45' ' ' VAL . 2.6 m -97.77 175.92 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.02 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -98.53 155.76 17.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.886 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 27.1 m -85.93 155.38 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.031 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.14 -34.3 63.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.06 105.82 2.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.356 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.06 49.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.879 0.371 . . . . 0.0 111.173 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.633 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 20.7 mt-10 -74.47 -50.74 4.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.301 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.633 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 31.8 Cg_exo -59.54 121.35 9.73 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.297 1.998 . . . . 0.0 112.319 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.708 ' HB2' HD11 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -69.46 134.64 49.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.033 179.841 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.895 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -169.8 -177.81 2.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.175 178.312 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -52.32 -35.79 51.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.611 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 5.7 m -66.58 -47.91 71.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.364 . . . . 0.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.611 ' HE2' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.17 -41.98 85.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.258 0.551 . . . . 0.0 110.369 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.483 HD12 HD21 ' A' ' 105' ' ' LEU . 8.1 mt -63.17 -45.94 89.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.812 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.58 -10.34 44.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.488 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -83.15 -8.02 59.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.736 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.655 ' HB3' ' H ' ' A' ' 65' ' ' GLU . . . -133.37 56.63 21.93 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.182 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.749 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 53.6 Cg_exo -52.73 -51.17 11.72 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.491 2.127 . . . . 0.0 113.337 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.604 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 67.8 Cg_endo -94.58 12.56 1.55 Allowed 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.434 2.089 . . . . 0.0 112.632 -179.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.668 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 5.5 tt0 -122.13 -95.07 0.49 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.628 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.668 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 0.0 OUTLIER -106.99 37.09 2.45 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.179 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.749 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -59.62 -50.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.96 0.41 . . . . 0.0 110.497 179.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -116.51 36.03 4.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.577 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -126.76 -50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.421 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.649 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.2 OUTLIER -80.62 -3.38 50.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.642 -178.668 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.73 HD12 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -61.09 -38.57 86.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.39 -179.767 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.768 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.94 28.91 2.78 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.581 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -142.95 0.18 1.19 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.419 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.37 -22.62 2.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.692 179.157 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.717 ' HB3' ' HG1' ' A' ' 90' ' ' THR . 0.3 OUTLIER -75.98 -24.88 55.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.826 178.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.433 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -41.14 -55.96 4.58 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.044 -177.931 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.433 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.0 Cg_endo -71.48 -15.37 30.94 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.028 1.819 . . . . 0.0 112.232 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.708 HD11 ' HB2' ' A' ' 53' ' ' LEU . 81.3 mt -92.16 -20.64 21.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.524 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.709 HD13 ' HG1' ' A' ' 90' ' ' THR . 8.6 mm -73.08 -36.17 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.69 ' HG2' HG21 ' A' ' 84' ' ' THR . 3.7 mt-30 -52.8 -13.06 0.37 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.097 177.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -84.09 -44.42 14.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.9 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.708 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.45 -35.78 73.53 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.526 0.679 . . . . 0.0 110.164 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.6 ' CE1' HG23 ' A' ' 119' ' ' VAL . 5.5 m170 -119.53 139.91 28.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.944 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' A' ' 82' ' ' HIS . 54.7 Cg_exo -30.98 -48.91 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.82 2.347 . . . . 0.0 112.215 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.69 HG21 ' HG2' ' A' ' 79' ' ' GLN . 0.0 OUTLIER 176.59 14.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.89 177.509 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.457 ' C ' HD12 ' A' ' 89' ' ' ILE . 2.5 mp -66.86 3.87 0.97 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.424 -179.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.584 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.32 47.37 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.247 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.78 -7.32 78.48 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.927 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 4.8 ttpt -174.4 28.35 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.783 0.325 . . . . 0.0 110.977 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.688 HG22 HG11 ' A' ' 115' ' ' VAL . 56.1 mt -80.1 -83.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.757 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.768 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.1 -40.88 59.43 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.476 0.179 . . . . 0.0 110.669 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.14 -31.76 56.46 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.927 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 4.6 ttm -73.8 -39.34 64.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.272 176.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.655 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -54.18 -10.76 0.39 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.843 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 70' ' ' LEU . 1.7 mm? -105.15 28.68 7.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 92' ' ' MET . 7.4 pt-20 -171.52 -0.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.04 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 1.001 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.92 -150.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.488 0.661 . . . . 0.0 111.735 -179.325 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.571 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.7 t70 -55.49 -9.35 0.47 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.204 176.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.712 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.3 m120 79.45 -24.64 0.2 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.103 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -74.32 -29.35 61.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 1.001 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.57 -38.53 62.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.556 176.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 0.3 OUTLIER -64.23 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.986 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.412 ' HA ' HD23 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -87.36 -48.62 7.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.203 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.413 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.1 -41.43 94.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.318 -178.299 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.764 ' HE3' HD23 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -56.32 -34.31 66.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.443 -179.354 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.556 ' N ' ' HG3' ' A' ' 104' ' ' MET . 12.2 mt -86.66 -11.22 51.95 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.797 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.16 -7.99 15.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.737 0.644 . . . . 0.0 112.737 -176.68 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.73 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -141.95 135.73 14.63 Favored Pre-proline 0 C--N 1.332 -0.164 0 C-N-CA 120.598 -0.441 . . . . 0.0 112.008 -178.69 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.473 ' O ' HG21 ' A' ' 54' ' ' THR . 62.5 Cg_endo -72.18 0.52 7.19 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.697 2.265 . . . . 0.0 111.906 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -123.99 -10.89 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.323 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.73 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.81 -46.89 17.75 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.095 0.474 . . . . 0.0 109.737 178.059 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.895 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.5 -39.62 16.49 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.163 176.336 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.421 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.5 ttt-85 -80.18 -59.2 2.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.273 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.421 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 3.3 t -52.66 -56.82 12.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.981 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.549 ' HD3' ' HG3' ' A' ' 100' ' ' GLU . 0.8 OUTLIER -55.21 -32.24 62.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.688 HG11 HG22 ' A' ' 89' ' ' ILE . 1.8 t -69.58 -60.96 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.079 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.525 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.7 OUTLIER -50.24 -36.8 32.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 111.176 178.767 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -38.99 65.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.263 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.503 ' O ' ' HE2' ' A' ' 92' ' ' MET . . . -61.85 -30.02 70.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 177.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.6 HG23 ' CE1' ' A' ' 82' ' ' HIS . 14.6 t -56.2 -53.74 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.933 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.44 -27.07 22.78 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.928 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.552 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 9.2 t -85.68 -31.71 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.954 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.665 ' HA ' ' HZ2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.82 -43.39 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.815 179.211 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.49 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 18.1 mm100 -68.88 -25.6 64.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.214 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.419 ' HA ' ' CD ' ' A' ' 128' ' ' LYS . . . -88.66 -12.67 41.77 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.354 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.552 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -114.07 -2.92 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.499 -179.057 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 122' ' ' LEU . 6.4 mm-40 -68.65 -103.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.079 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.25 18.01 13.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.77 0.319 . . . . 0.0 111.252 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.419 ' CD ' ' HA ' ' A' ' 124' ' ' ALA . 0.2 OUTLIER -79.97 -156.22 0.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.113 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -87.2 -14.65 40.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.613 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.55 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -69.38 -13.8 62.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.097 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.84 101.75 0.22 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.086 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -80.53 137.85 36.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.957 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -80.52 154.36 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -93.34 77.39 4.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.015 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.62 -28.88 3.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -84.83 166.39 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.013 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.61 16.22 16.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -84.69 -2.54 57.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.023 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.68 143.62 26.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -79.18 112.5 3.46 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.574 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 10.5 m -78.64 140.72 59.54 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.088 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.7 103.4 1.56 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.496 2.13 . . . . 0.0 112.329 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.1 m -83.51 -74.34 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.014 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.014 -179.992 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.45 161.49 31.12 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.616 2.211 . . . . 0.0 112.15 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.99 25.06 6.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.38 -10.73 67.73 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.418 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -76.63 -178.44 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.45 23.01 2.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -161.61 -95.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.52 20.66 5.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.283 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -165.39 -37.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.103 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.5 89.37 0.11 Allowed Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.06 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.3 155.48 55.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.528 2.152 . . . . 0.0 112.287 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.52 -67.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.986 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.96 134.59 29.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.034 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 -33.73 22.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.037 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.1 m -82.75 146.88 28.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.048 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.441 HG22 ' HD2' ' A' ' 17' ' ' PRO . 4.5 p -100.65 127.25 33.06 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.504 ' HB2' ' H ' ' A' ' 18' ' ' GLN . 88.1 Cg_endo -77.8 -134.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.563 2.176 . . . . 0.0 112.161 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.504 ' H ' ' HB2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -70.73 155.76 40.36 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 110.886 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -79.26 58.58 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.127 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.63 85.3 2.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.009 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -88.6 74.6 8.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.944 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -89.85 153.96 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.041 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.55 35.04 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.068 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.81 -4.83 89.57 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.492 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.7 t -108.38 -33.34 2.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.82 0.343 . . . . 0.0 110.958 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -77.13 140.0 40.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.91 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -71.8 147.96 92.02 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.68 100.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.517 2.145 . . . . 0.0 112.288 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -85.67 80.09 9.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -89.38 168.13 12.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -64.14 -30.13 71.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 mp -92.17 104.08 16.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.976 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -84.91 -55.98 3.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.811 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -94.59 177.17 6.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.064 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -104.89 102.36 34.95 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.02 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.36 113.99 3.79 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.397 2.065 . . . . 0.0 112.262 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -85.01 122.72 29.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.975 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.99 137.43 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.952 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -105.6 108.73 20.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.998 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.12 127.42 46.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -105.01 103.32 12.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.012 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 58.33 95.23 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.203 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.72 138.42 39.39 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.528 -1.447 . . . . 0.0 112.541 -0.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -90.12 104.38 16.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.033 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.28 141.58 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.181 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -87.48 158.6 18.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.439 ' HB ' ' H ' ' A' ' 48' ' ' GLN . 1.7 m -110.83 -157.09 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.962 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.439 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 22.3 mt-30 -68.07 -176.89 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.927 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.84 37.66 3.07 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.509 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.68 37.53 1.69 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.722 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' N ' ' CD ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -77.6 -48.69 2.26 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.574 -179.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' CD ' ' N ' ' A' ' 51' ' ' GLU . 52.0 Cg_exo -55.87 178.0 0.12 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.317 2.012 . . . . 0.0 112.452 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.7 ' HB3' HD12 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -79.76 141.21 36.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.164 -179.554 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.533 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.33 -169.06 1.01 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.682 178.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.575 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.52 -40.26 65.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.665 0.269 . . . . 0.0 111.431 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.691 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.5 m -59.27 -51.54 69.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.715 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.691 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.56 -39.11 79.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.296 179.069 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 55' ' ' ALA . 17.8 mt -62.9 -42.89 99.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.89 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.2 -16.72 62.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.148 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.9 m -74.19 -7.21 51.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 64' ' ' GLN . . . -133.65 60.12 44.5 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.357 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.604 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 47.0 Cg_exo -56.63 -51.97 7.96 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.448 2.099 . . . . 0.0 113.246 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.58 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 74.9 Cg_endo -89.87 -18.01 1.57 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 122.262 1.975 . . . . 0.0 112.537 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 0.9 OUTLIER -80.91 -80.57 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.731 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.561 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.3 OUTLIER -106.85 -91.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.604 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER 71.69 -63.53 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.397 -178.489 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HA ' ' CD2' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.08 25.22 12.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 178.856 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.497 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 2.2 mm100 -121.58 -50.76 2.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.57 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -81.17 5.97 15.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.92 -178.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.717 HD12 HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.86 -57.27 8.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 179.816 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.747 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -113.05 33.62 5.49 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.732 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -144.41 -3.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.824 0.345 . . . . 0.0 111.297 -178.686 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.638 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -125.68 -26.26 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.527 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.89 ' HB2' HG22 ' A' ' 90' ' ' THR . 1.6 mm? -63.5 -33.14 74.92 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.297 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.79 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.2 t80 -39.2 -60.23 1.27 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.79 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 32.5 Cg_exo -57.92 -19.45 39.8 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 121.851 1.701 . . . . 0.0 112.342 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.671 HD21 ' H ' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -98.83 -25.96 14.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.318 -178.109 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.68 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 5.4 mm -65.85 -40.03 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.758 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -51.5 -19.36 1.4 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.521 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.26 -36.85 26.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.837 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.469 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.79 -34.56 64.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.75 ' ND1' HG12 ' A' ' 119' ' ' VAL . 2.6 m-70 -130.44 148.03 68.3 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.572 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.433 ' HD2' HD11 ' A' ' 85' ' ' LEU . 51.2 Cg_exo -55.65 79.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.537 2.158 . . . . 0.0 112.364 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.758 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.0 p 42.89 37.68 1.17 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.529 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.518 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 10.8 mt -95.66 12.46 29.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.1 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.68 ' HB3' ' HB ' ' A' ' 78' ' ' ILE . . . -76.02 24.16 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.558 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.18 -19.14 44.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.681 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.639 ' HB3' HD12 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -169.11 32.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.89 0.376 . . . . 0.0 111.012 179.681 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.684 HG22 HG12 ' A' ' 115' ' ' VAL . 64.0 mt -80.56 -92.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.888 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.89 HG22 ' HB2' ' A' ' 74' ' ' LEU . 0.6 OUTLIER -50.82 -40.56 56.02 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.01 -31.33 55.78 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.209 -0.996 . . . . 0.0 110.973 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.717 ' HG2' HG22 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -84.79 -22.16 29.67 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 120.864 0.364 . . . . 0.0 110.098 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.63 ' HG ' HG23 ' A' ' 115' ' ' VAL . 4.4 mm? -62.48 -4.41 1.9 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.195 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.717 HD13 HD12 ' A' ' 70' ' ' LEU . 3.1 mp -106.61 24.32 12.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.42 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 10.5 pt-20 -166.8 0.83 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.481 -178.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.908 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -152.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.554 0.693 . . . . 0.0 111.797 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.452 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.4 t0 -59.27 -3.28 0.38 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.157 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.603 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.62 -34.07 0.14 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.244 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.463 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -69.18 -24.79 64.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.102 178.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.908 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.3 mt-10 -84.04 -27.05 28.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.427 177.253 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.669 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.1 OUTLIER -74.89 -27.48 60.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.246 175.886 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' A' ' 102' ' ' LEU . 0.9 OUTLIER -83.92 -48.79 9.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.873 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.513 ' ND1' ' HB3' ' A' ' 110' ' ' SER . 0.2 OUTLIER -61.93 -47.74 83.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.422 -178.57 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.669 ' SD ' ' HA ' ' A' ' 101' ' ' LEU . 5.7 ptm -52.15 -36.44 51.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.455 -178.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.684 HD13 HD23 ' A' ' 70' ' ' LEU . 54.4 mt -81.83 -14.71 55.94 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.857 -179.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.2 -10.61 16.38 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -176.934 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.513 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -143.2 136.27 13.86 Favored Pre-proline 0 N--CA 1.465 0.278 0 C-N-CA 120.283 -0.567 . . . . 0.0 112.241 -178.62 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 7.6 Cg_exo -73.69 3.88 4.52 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.017 2.478 . . . . 0.0 112.156 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -123.99 -22.07 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.561 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.513 ' HB3' ' ND1' ' A' ' 103' ' ' HIS . 2.4 p -64.05 -55.97 18.32 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.377 0.608 . . . . 0.0 109.857 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.547 HD12 HD23 ' A' ' 74' ' ' LEU . 7.5 tt -48.8 -31.09 6.48 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.572 -179.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.411 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 7.2 ttt85 -88.17 -60.56 1.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.308 -179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.6 m -56.5 -34.75 67.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.122 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.585 ' O ' ' HB1' ' A' ' 118' ' ' ALA . 6.5 mmtp -78.5 -31.22 47.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.78 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.684 HG12 HG22 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.77 -51.71 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.31 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.665 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -58.43 -32.96 69.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.336 177.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -79.58 -31.07 41.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.574 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.612 ' O ' ' HE3' ' A' ' 92' ' ' MET . . . -68.32 -23.77 64.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.492 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.75 HG12 ' ND1' ' A' ' 82' ' ' HIS . 17.0 t -64.86 -57.24 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.609 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.414 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -53.27 -23.78 9.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.885 177.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.552 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 24.2 t -86.62 -32.54 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.433 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.639 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.68 -43.87 65.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.234 179.207 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.534 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -66.19 -31.5 72.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.829 178.327 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.419 ' HA ' ' CD ' ' A' ' 128' ' ' LYS . . . -81.76 -16.28 51.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.139 179.133 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.552 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -112.51 8.21 19.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.172 -179.566 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -77.3 -105.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.809 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.58 23.01 6.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.787 0.327 . . . . 0.0 111.325 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.419 ' CD ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -89.04 -146.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.138 -179.483 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.62 19.35 1.05 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.518 ' HB3' ' ND1' ' A' ' 125' ' ' HIS . . . -62.09 -54.47 40.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.087 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -82.43 118.27 23.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.018 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -89.47 -78.34 0.36 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.26 134.4 41.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.62 -69.84 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.046 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 15.2 m -103.05 139.46 23.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.021 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.39 59.58 4.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.44 145.92 29.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.891 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.82 -35.53 78.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.997 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 97.71 10.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.04 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -107.2 -144.46 11.58 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.641 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.631 HG21 ' HA ' ' A' ' 142' ' ' PRO . 6.2 p -72.43 134.38 82.34 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.444 0.164 . . . . 0.0 111.025 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.631 ' HA ' HG21 ' A' ' 141' ' ' VAL . 61.3 Cg_endo -90.28 -77.61 0.0 OUTLIER 'Cis proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.777 -1.343 . . . . 0.0 112.583 0.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.3 m -99.57 -67.59 0.84 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.824 0.345 . . . . 0.0 110.888 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 9.5 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.037 -179.841 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 121.96 8.82 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.578 2.185 . . . . 0.0 112.356 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.0 3.57 33.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.778 179.876 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.5 149.06 16.65 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.563 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.4 m -93.84 47.79 1.24 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.683 0.278 . . . . 0.0 110.947 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.71 115.38 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.19 69.28 0.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.056 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.72 142.75 36.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.125 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -104.79 18.31 22.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.121 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.0 p -120.14 86.31 37.35 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.29 142.08 48.96 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.594 2.196 . . . . 0.0 112.348 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.42 32.91 2.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 179.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 t -89.76 101.08 11.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.096 179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -77.26 -5.7 50.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.95 -162.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.907 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.89 118.93 42.0 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.13 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.34 -16.2 31.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.602 2.202 . . . . 0.0 112.288 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -92.93 122.51 35.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.895 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -78.2 174.96 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.21 131.94 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.97 179.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -86.12 96.99 10.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.3 95.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.072 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.72 113.09 9.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.058 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.21 -14.22 39.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.503 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.0 p -98.85 141.28 16.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.409 ' HG2' ' H ' ' A' ' 27' ' ' ASN . 0.1 OUTLIER -86.12 157.42 20.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.828 179.95 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.409 ' H ' ' HG2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -98.41 118.78 62.89 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.952 179.972 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.69 -64.52 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.56 2.173 . . . . 0.0 112.115 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -99.8 -167.99 1.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.437 ' HB2' ' H ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -94.75 -88.02 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.852 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.437 ' H ' ' HB2' ' A' ' 30' ' ' GLN . 0.3 OUTLIER 55.48 19.8 3.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.904 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.63 177.08 5.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.46 -171.68 3.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.805 179.84 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.41 120.06 23.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -51.11 1.19 Allowed Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.393 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.42 137.01 75.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.134 1.89 . . . . 0.0 112.215 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -92.31 139.82 30.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.811 179.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.42 ' H ' HG21 ' A' ' 38' ' ' VAL . 2.5 m -90.7 117.47 34.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.275 -179.667 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -104.8 -44.87 4.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 179.521 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -146.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.703 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 58.0 -146.88 0.52 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.743 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.04 123.1 51.94 Favored Pre-proline 0 C--O 1.232 0.181 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.932 -179.911 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.53 121.86 10.69 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.62 2.214 . . . . 0.0 112.475 -179.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -84.16 122.66 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.917 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.457 ' H ' HG22 ' A' ' 45' ' ' VAL . 3.8 m -82.72 2.66 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.354 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -87.95 130.98 34.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.82 179.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.49 HG21 ' HG3' ' A' ' 52' ' ' PRO . 11.4 t -106.24 131.2 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.019 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -84.51 -5.93 59.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.929 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.2 -93.4 1.51 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.469 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.54 142.41 35.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.813 0.34 . . . . 0.0 110.856 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 119.95 74.29 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.896 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.49 ' HG3' HG21 ' A' ' 47' ' ' VAL . 34.0 Cg_exo -60.09 164.04 13.11 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.631 2.221 . . . . 0.0 112.264 -179.84 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.777 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -76.74 147.06 37.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.841 179.75 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.628 ' HA ' HD23 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -169.44 -161.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.37 179.229 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.572 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -58.26 -35.38 71.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.394 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.781 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 72.9 m -60.39 -49.43 77.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.223 179.156 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.781 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.22 -42.34 86.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.306 178.659 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.572 HD21 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.93 -45.11 91.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.815 179.459 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.27 -16.07 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.337 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.5 t -75.95 -13.52 60.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.744 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.582 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -134.89 61.1 45.31 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.993 179.497 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.801 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 52.9 Cg_exo -54.95 -53.1 6.52 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.451 2.101 . . . . 0.0 113.245 -178.801 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.622 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.5 Cg_endo -97.69 11.14 1.03 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 122.58 2.187 . . . . 0.0 112.567 -179.28 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.582 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 20.6 mm-40 -113.97 -93.6 0.48 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.593 -178.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.778 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.11 36.89 2.52 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.044 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.801 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.02 -35.89 81.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 0.0 110.505 179.086 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.87 39.69 3.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.785 179.55 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.468 ' C ' HD12 ' A' ' 70' ' ' LEU . 1.2 mt-30 -135.82 -59.27 0.76 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.371 -179.572 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.778 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 5.5 ptt? -79.89 12.48 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.859 -178.634 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.699 HD11 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -76.62 -40.56 48.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.748 0.309 . . . . 0.0 111.077 179.052 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.784 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -133.7 23.98 3.72 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.224 -0.989 . . . . 0.0 112.693 -179.276 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.61 -7.37 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.708 0.29 . . . . 0.0 111.225 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.56 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.8 tmt_? -127.13 -15.25 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.906 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.62 ' HB2' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -77.11 -8.86 58.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.228 179.524 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.707 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.1 t80 -50.02 -55.82 21.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.445 -178.516 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.707 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 19.9 Cg_exo -64.89 -9.64 22.11 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.057 1.838 . . . . 0.0 111.852 179.513 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.777 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.9 mm? -93.22 -34.21 13.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.365 -179.52 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.765 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.5 mm -66.74 -38.87 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.872 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.698 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.4 mt-30 -50.93 -18.25 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.444 0.64 . . . . 0.0 110.198 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -83.82 -43.11 15.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.225 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.765 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.71 -38.73 73.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.427 0.632 . . . . 0.0 110.424 -179.898 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.663 ' CE1' HG22 ' A' ' 119' ' ' VAL . 3.9 m170 -121.95 151.24 57.75 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.414 -177.132 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.826 ' HG2' HD23 ' A' ' 85' ' ' LEU . 30.5 Cg_endo -62.58 75.82 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.272 1.982 . . . . 0.0 111.778 179.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.698 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 50.43 28.85 3.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.743 -178.786 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.826 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -80.22 0.62 31.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.375 -178.897 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.625 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.78 -144.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.47 -3.58 86.12 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.915 -179.441 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.578 ' HZ3' ' HG3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -167.82 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.778 -0.211 . . . . 0.0 111.111 -179.826 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.643 HD11 ' ND1' ' A' ' 82' ' ' HIS . 76.6 mt -49.68 -82.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.689 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.784 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -55.57 -38.12 68.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.597 0.237 . . . . 0.0 110.729 179.748 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.54 -29.05 57.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.686 177.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.641 ' O ' HG22 ' A' ' 96' ' ' ILE . 2.3 ttp -76.88 -33.62 57.82 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.098 -0.551 . . . . 0.0 109.876 177.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.651 ' HG ' HG21 ' A' ' 115' ' ' VAL . 4.6 mm? -59.86 -5.2 0.88 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.642 -178.215 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.616 HD11 ' HA3' ' A' ' 71' ' ' GLY . 3.2 mp -109.08 25.78 11.4 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 176.483 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -169.91 3.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.289 -178.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.92 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.06 -151.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.242 0.544 . . . . 0.0 111.66 -179.752 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 6.3 t0 -59.53 -2.48 0.34 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.206 178.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.559 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-80 78.0 -28.74 0.16 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.443 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.6 m -75.32 -27.05 59.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.054 0.454 . . . . 0.0 109.888 178.092 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.92 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -80.41 -22.19 41.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.938 177.916 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.532 HD21 HD12 ' A' ' 94' ' ' LEU . 2.1 tm? -75.2 -24.98 57.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.723 176.73 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.3 mp -90.25 -45.14 9.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.359 -179.21 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.09 -36.79 80.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.007 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.635 ' HE3' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.87 -36.03 73.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 179.785 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.582 ' N ' ' HG3' ' A' ' 104' ' ' MET . 11.7 mt -87.01 -10.47 53.05 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.186 0.517 . . . . 0.0 109.991 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -108.02 -3.46 18.72 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.157 -176.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.808 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -150.75 131.46 7.22 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.204 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.03 -2.02 8.04 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.931 2.42 . . . . 0.0 112.064 179.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.468 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -117.31 -28.52 6.12 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.343 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.808 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -62.63 -42.93 99.87 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.469 -178.887 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.635 ' HG ' ' HE3' ' A' ' 104' ' ' MET . 5.9 tt -61.25 -30.6 70.55 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.281 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.525 ' HG2' ' N ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -89.48 -63.52 1.27 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 0.0 110.5 180.0 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.525 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 2.7 m -49.41 -36.85 23.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.386 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.468 ' HD2' ' OE2' ' A' ' 100' ' ' GLU . 33.3 mmtt -80.1 -35.71 36.47 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.044 178.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.651 HG21 ' HG ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -60.59 -50.23 81.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.561 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.457 ' HA ' HG23 ' A' ' 119' ' ' VAL . 30.1 t70 -55.82 -37.16 68.29 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.094 178.304 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -39.67 69.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.85 178.487 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.66 -25.97 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.663 HG22 ' CE1' ' A' ' 82' ' ' HIS . 17.0 t -59.68 -53.94 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.496 176.638 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.23 -26.37 28.3 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.918 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.517 ' O ' HG12 ' A' ' 121' ' ' VAL . 17.5 t -85.76 -31.03 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.918 179.575 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.574 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.95 -41.36 62.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 110.014 179.27 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.515 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 34.7 mm-40 -63.37 -34.3 77.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.879 178.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.704 ' HB1' ' HG2' ' A' ' 128' ' ' LYS . . . -76.35 -42.38 45.04 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.678 177.734 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.483 ' CD2' ' HB2' ' A' ' 131' ' ' ALA . 12.1 t-160 -68.75 -24.82 64.49 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.347 -178.963 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -82.84 -46.14 13.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.21 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.76 -46.81 6.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.864 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.704 ' HG2' ' HB1' ' A' ' 124' ' ' ALA . 2.0 ptpt -96.19 179.42 5.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.616 0.722 . . . . 0.0 111.642 -178.575 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.596 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 0.5 OUTLIER -90.78 53.2 2.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.04 176.198 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.559 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.0 -72.65 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.686 -176.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.483 ' HB2' ' CD2' ' A' ' 125' ' ' HIS . . . -76.07 120.48 21.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.35 -179.129 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.33 141.34 31.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.685 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -71.62 -7.32 47.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.69 101.9 14.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.055 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.5 p -79.87 -20.79 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.413 HD21 ' H ' ' A' ' 137' ' ' SER . 0.1 OUTLIER -74.37 -166.87 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.054 -179.911 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.413 ' H ' HD21 ' A' ' 136' ' ' ASN . 0.1 OUTLIER -88.85 40.7 0.99 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.938 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -84.0 -38.14 21.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.959 179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 9.2 t -96.66 18.94 13.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -86.72 61.4 4.38 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.535 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.644 HG22 ' HD2' ' A' ' 142' ' ' PRO . 6.8 p -79.89 131.85 62.42 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 110.925 179.751 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.644 ' HD2' HG22 ' A' ' 141' ' ' VAL . 34.0 Cg_endo -63.71 171.37 7.16 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.429 2.086 . . . . 0.0 112.256 -179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 2.8 t -77.55 157.4 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.026 179.92 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.27 -21.07 50.48 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.654 2.236 . . . . 0.0 112.208 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mp -69.93 146.76 50.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.888 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.55 149.28 16.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.395 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 t -104.64 -24.2 13.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.333 . . . . 0.0 110.929 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 55.24 79.59 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.128 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 10' ' ' THR . . . -143.94 166.57 24.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.986 -179.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.52 115.07 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.026 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 56.29 79.37 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.11 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.602 HG22 ' HB2' ' A' ' 7' ' ' ALA . 78.7 p -132.13 127.42 20.97 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.65 170.0 21.3 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.467 2.112 . . . . 0.0 112.327 179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.32 -19.75 16.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.022 179.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.9 150.78 5.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.983 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.07 25.34 4.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.008 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.401 ' O ' ' HD3' ' A' ' 17' ' ' PRO . 2.0 m -91.19 157.63 17.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -97.63 107.07 37.42 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.968 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 15' ' ' THR . 7.8 Cg_exo -73.27 -78.24 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.832 2.355 . . . . 0.0 112.409 -179.28 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.23 178.29 7.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.153 -179.455 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -73.48 126.58 30.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.965 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -77.74 173.85 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.01 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -93.48 166.92 12.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.034 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -84.21 -44.64 13.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.191 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.0 -16.92 64.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.201 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.76 78.93 1.46 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.49 -26.62 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.822 0.344 . . . . 0.0 110.957 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -89.58 23.68 2.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.082 -179.846 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.465 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -72.79 -51.3 6.76 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.465 -179.83 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.465 ' HD2' ' N ' ' A' ' 27' ' ' ASN . 59.3 Cg_endo -72.05 94.87 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.083 1.855 . . . . 0.0 112.324 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.89 93.33 7.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.875 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -73.23 -78.63 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.833 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 55.81 26.8 10.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.993 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mt -80.88 -66.31 0.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.871 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -91.66 171.93 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.41 129.11 37.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.986 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.477 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 38.5 mt-30 -87.44 -50.92 0.43 Allowed Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.353 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 59.8 Cg_endo -71.83 -171.99 0.75 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.167 1.911 . . . . 0.0 112.299 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -94.74 123.11 38.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.868 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.8 t -92.56 -30.22 4.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.111 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.1 m -80.63 -16.36 54.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.935 -179.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 11.0 ttt -96.11 40.85 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.974 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -165.94 87.85 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 56.4 91.16 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.85 144.69 34.51 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.536 2.157 . . . . 0.0 112.407 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.21 87.58 7.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.135 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.98 -163.71 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.835 179.62 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -80.04 72.98 6.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.775 179.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 16.7 m -103.23 171.51 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.319 -179.721 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -148.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.804 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -72.25 120.33 7.71 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -97.19 171.18 8.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.849 0.357 . . . . 0.0 111.204 -179.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.431 ' HB2' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -65.11 159.58 63.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.875 179.783 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' HA ' ' HB2' ' A' ' 51' ' ' GLU . 85.1 Cg_endo -88.55 -155.87 0.9 Allowed 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.896 -1.293 . . . . 0.0 112.703 0.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.666 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -69.29 151.79 45.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.811 179.805 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.877 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -163.03 -177.19 5.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.771 179.442 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -50.08 -38.0 36.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.066 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.614 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 4.1 m -61.44 -45.14 95.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.489 179.333 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.666 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.46 -43.38 96.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.057 178.692 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.96 -46.2 88.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.619 179.345 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.34 -9.74 58.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.109 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.3 t -80.76 -8.29 59.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.798 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.712 ' HB2' ' H ' ' A' ' 65' ' ' GLU . . . -134.16 60.06 41.85 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.076 179.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.765 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 53.0 Cg_exo -52.38 -51.94 10.02 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.535 2.157 . . . . 0.0 113.131 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.3 Cg_endo -95.28 16.59 0.91 Allowed 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.451 2.101 . . . . 0.0 112.606 -179.551 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.401 ' HB2' ' H ' ' A' ' 65' ' ' GLU . 6.5 mt-30 -126.37 -94.75 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.611 -178.852 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.764 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.01 38.54 2.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.713 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.765 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -60.26 -50.2 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.515 179.432 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -120.0 38.4 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.564 179.199 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.434 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 65.2 tt0 -127.81 -56.07 1.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.361 -179.126 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.764 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.2 ptt? -74.91 1.18 13.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -178.816 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.659 HD21 HD11 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -65.09 -41.52 94.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.672 -179.457 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.696 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.04 26.67 3.39 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.563 -179.119 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -138.98 -4.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.994 0.426 . . . . 0.0 110.895 179.754 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.566 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 4.5 tpm_? -126.99 -24.41 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.987 179.864 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -74.9 -30.03 61.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.328 179.703 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.466 ' HD1' ' HA ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -40.04 -54.67 4.3 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.031 -178.089 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.8 Cg_endo -65.27 -26.28 56.59 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.934 1.756 . . . . 0.0 112.028 178.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.451 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 63.8 mt -81.57 -20.97 38.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.687 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 15.6 mm -69.53 -36.95 73.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.808 0.337 . . . . 0.0 110.112 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.646 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.2 mt-30 -53.41 -14.78 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 178.049 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.403 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -82.71 -40.42 20.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.698 178.702 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.687 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.25 -45.52 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.188 0.518 . . . . 0.0 110.142 179.26 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.658 ' ND1' HG13 ' A' ' 119' ' ' VAL . 9.3 m-70 -112.3 145.51 33.01 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.927 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.442 ' O ' ' HB ' ' A' ' 84' ' ' THR . 18.2 Cg_exo -30.97 -49.08 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.26 2.64 . . . . 0.0 112.456 -179.354 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.646 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 11.6 t 173.85 22.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.938 178.567 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -72.24 11.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.566 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.68 ' HB1' ' HB ' ' A' ' 78' ' ' ILE . . . -77.03 44.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.477 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -85.69 -10.7 75.77 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.332 177.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.594 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.5 tptt -175.11 31.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.245 179.414 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.67 HG21 HG13 ' A' ' 115' ' ' VAL . 62.1 mt -79.58 -89.35 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 120.806 -0.357 . . . . 0.0 110.561 179.119 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.696 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.54 -38.57 60.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 179.241 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.47 -31.91 57.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.993 178.01 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.802 ' HG2' HG22 ' A' ' 96' ' ' ILE . 38.4 ttp -83.37 -23.14 32.57 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.717 -0.241 . . . . 0.0 110.446 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.732 ' HA ' HG21 ' A' ' 96' ' ' ILE . 4.6 mm? -61.92 -6.18 2.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.497 178.68 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.654 HD22 HD12 ' A' ' 70' ' ' LEU . 2.0 mm? -108.99 20.84 17.96 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 176.476 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.643 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -162.52 1.72 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.473 -179.327 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.955 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.06 -152.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 121.35 0.595 . . . . 0.0 111.757 -179.9 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.4 t70 -59.43 -2.2 0.3 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.262 178.256 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.55 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.3 m-80 78.55 -31.16 0.15 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.53 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.3 m -73.1 -29.54 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.02 0.438 . . . . 0.0 109.924 178.353 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.955 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -78.28 -21.84 49.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.757 177.533 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 1.8 tp -75.25 -25.01 57.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.902 176.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.2 mp -90.63 -46.34 8.34 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.286 -179.127 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -37.78 88.74 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.116 -178.926 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.835 ' HE2' HD21 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -60.86 -36.67 79.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.55 -179.657 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.659 HD11 HD21 ' A' ' 70' ' ' LEU . 11.6 mt -87.38 -6.03 58.63 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 110.518 179.639 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 58.8 mm-40 -109.5 -13.48 14.56 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.642 -175.701 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -138.3 139.11 24.26 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -176.825 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 8.2 Cg_exo -74.24 19.55 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 112.366 179.571 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.1 OUTLIER -146.77 -26.14 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.99 -179.957 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 107' ' ' SER . 0.6 OUTLIER -62.92 -41.25 99.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.58 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.877 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.08 -28.1 1.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.964 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -96.24 -65.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.076 -179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 31.9 t -46.95 -29.28 1.96 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.374 . . . . 0.0 110.262 179.368 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 39.3 mmtt -80.69 -42.34 22.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.723 177.784 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.67 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -64.79 -60.07 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.154 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -49.34 -40.64 36.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.864 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.56 -33.87 64.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.908 0.385 . . . . 0.0 110.338 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.494 ' HB1' ' O ' ' A' ' 114' ' ' LYS . . . -68.14 -21.66 64.91 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.975 178.24 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.814 ' HA ' HD22 ' A' ' 122' ' ' LEU . 24.2 t -67.83 -46.15 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.738 176.813 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.45 -32.08 72.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.575 177.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 121' ' ' VAL . 12.2 t -79.41 -30.81 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.614 179.166 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.814 HD22 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -74.69 -42.02 59.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.29 179.904 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.18 -30.66 70.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.707 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.617 ' HB2' ' HG2' ' A' ' 128' ' ' LYS . . . -72.64 -52.53 15.01 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.435 177.354 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.1 -17.02 64.69 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.505 -178.855 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -87.4 -50.51 6.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.786 0.327 . . . . 0.0 111.021 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.86 -42.46 8.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.871 -179.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.617 ' HG2' ' HB2' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.6 175.7 6.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.599 0.714 . . . . 0.0 111.563 -178.6 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.5 63.63 5.6 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.027 176.47 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.33 -67.84 0.29 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.301 -177.272 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.44 148.34 31.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.055 179.792 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -78.68 -177.47 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -85.32 -176.73 6.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -79.27 92.82 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.028 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 5.2 m -90.54 141.91 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -75.17 -76.03 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.38 142.62 27.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.31 85.41 0.79 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.137 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.9 t -117.26 -20.75 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.99 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.18 -51.44 2.06 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.453 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -71.67 134.29 84.1 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.614 0.245 . . . . 0.0 111.099 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.8 127.96 11.26 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.492 2.128 . . . . 0.0 112.359 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 p -88.37 -66.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.164 -179.916 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.07 77.98 2.66 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.575 2.183 . . . . 0.0 112.342 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.0 tp -82.55 119.61 24.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.27 41.18 2.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.6 m -89.58 93.54 9.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.79 0.328 . . . . 0.0 110.965 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -133.16 100.01 4.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.972 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -115.44 172.17 7.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.132 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -123.23 149.42 44.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -137.64 -159.3 0.94 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.036 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 45.2 p -57.19 151.43 36.11 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.969 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -81.36 -1.0 46.13 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.471 0.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 89.16 0.65 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.152 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -86.15 141.49 14.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.021 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.76 131.26 44.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 -179.844 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.89 86.1 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.021 -179.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.566 HG22 ' HA ' ' A' ' 17' ' ' PRO . 7.7 p -102.96 132.73 20.88 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.877 179.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.566 ' HA ' HG22 ' A' ' 16' ' ' VAL . 67.3 Cg_endo -74.75 146.22 86.12 Favored 'Cis proline' 0 C--N 1.349 0.584 0 C-N-CA 123.565 -1.431 . . . . 0.0 112.517 0.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.96 126.03 28.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 179.936 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.99 -178.85 5.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.78 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -78.17 139.0 38.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.905 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.64 96.71 0.28 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.04 -56.4 3.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.074 -179.838 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.65 107.13 2.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.233 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.47 -76.33 1.01 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.396 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.4 t -101.99 117.88 47.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.818 0.342 . . . . 0.0 110.953 179.657 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.6 mtm-85 -74.43 83.32 1.96 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.029 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.462 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 2.1 m-20 -91.79 -51.38 0.3 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.23 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' A' ' 27' ' ' ASN . 66.1 Cg_endo -73.24 98.71 1.04 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.151 1.901 . . . . 0.0 112.16 179.762 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.404 ' HB2' ' H ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -91.2 -84.25 0.26 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.89 -179.714 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.404 ' H ' ' HB2' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -100.25 -165.63 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.949 -179.905 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.94 15.21 0.84 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.938 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mp -92.6 -77.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.912 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -104.38 74.48 1.18 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.837 -179.98 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.13 126.56 30.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.135 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.417 ' HB3' ' HA ' ' A' ' 36' ' ' PRO . 11.5 mm100 -91.69 155.63 43.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.72 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.417 ' HA ' ' HB3' ' A' ' 35' ' ' GLN . 3.1 Cg_exo -76.37 -53.33 0.16 OUTLIER 'Cis proline' 0 C--N 1.348 0.515 0 C-N-CA 123.941 -1.275 . . . . 0.0 112.326 0.916 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.82 131.36 35.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.049 -179.575 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.9 t -80.76 160.67 4.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.029 179.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.09 34.32 2.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.963 -179.89 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.78 161.11 14.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -128.67 179.1 5.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -163.61 145.34 7.43 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.097 179.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.11 84.29 1.52 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.595 2.197 . . . . 0.0 112.267 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.25 176.42 7.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.126 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -92.49 18.47 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.091 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.19 117.71 21.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 16.2 m -101.49 -178.26 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -90.64 -179.26 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.07 119.04 4.91 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.611 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -86.33 39.56 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 111.049 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.41 -50.76 6.01 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.378 179.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.29 176.13 0.88 Allowed 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.261 1.974 . . . . 0.0 112.542 -179.519 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.707 ' HB2' HD13 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -69.6 136.49 51.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.016 179.624 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.86 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -169.59 -178.72 3.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.144 178.329 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -51.3 -33.68 29.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.504 ' HB3' ' HE3' ' A' ' 57' ' ' MET . 0.4 OUTLIER -68.7 -47.97 65.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.793 -179.885 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.504 ' HE3' ' HB3' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.09 -37.82 75.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.491 0.662 . . . . 0.0 109.749 178.431 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.596 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 15.7 mt -66.08 -44.15 85.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.638 179.239 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.37 -9.67 35.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.562 178.803 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 57' ' ' MET . 40.1 m -78.94 -5.8 54.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.955 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.449 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -132.55 96.03 19.43 Favored Pre-proline 0 N--CA 1.451 -0.423 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.915 -179.291 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.607 ' O ' ' N ' ' A' ' 64' ' ' GLN . 50.6 Cg_exo -50.89 177.75 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.477 2.118 . . . . 0.0 110.263 177.002 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' C ' ' O ' ' A' ' 62' ' ' PRO . 57.5 Cg_exo -24.28 81.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.123 2.548 . . . . 0.0 112.782 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.695 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 2.9 tt0 -160.22 -83.65 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.23 -176.854 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.695 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 1.7 mm-40 -106.94 4.93 27.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.244 178.52 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 2.3 mt-30 -57.57 -20.18 30.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.882 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.8 ptmt -134.67 27.88 3.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.734 179.314 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.608 ' N ' HD23 ' A' ' 70' ' ' LEU . 3.3 mm100 -135.09 -49.43 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.916 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.596 ' HE1' ' HA ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -80.77 3.2 23.14 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -176.863 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -75.38 -35.31 61.1 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.107 0.48 . . . . 0.0 109.862 179.375 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.855 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -129.1 26.99 4.36 Favored Glycine 0 N--CA 1.438 -1.219 0 C-N-CA 119.847 -1.168 . . . . 0.0 112.702 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -144.34 -1.25 0.94 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.763 0.316 . . . . 0.0 111.381 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.0 -22.09 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.313 0.578 . . . . 0.0 109.972 179.118 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.666 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -78.09 -23.82 47.8 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.499 178.649 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.419 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -36.74 -54.63 1.67 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.438 -178.176 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.419 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.4 Cg_endo -72.1 -22.05 23.13 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.034 1.823 . . . . 0.0 112.795 -179.334 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.707 HD13 ' HB2' ' A' ' 53' ' ' LEU . 94.3 mt -89.36 -19.06 25.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.888 -178.73 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.832 HG13 ' HB ' ' A' ' 90' ' ' THR . 9.8 mm -73.79 -40.11 53.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 178.086 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.494 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.0 OUTLIER -53.89 -17.09 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.858 177.351 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.49 -37.88 35.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.868 178.732 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.701 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.25 -47.14 52.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.485 179.973 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.807 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.0 m-70 -113.33 148.97 40.74 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.622 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -56.3 79.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.433 2.088 . . . . 0.0 111.981 179.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.494 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 58.4 p 45.57 34.42 1.67 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.154 -178.483 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -89.7 6.95 39.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.016 -179.73 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -80.1 46.92 0.85 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.272 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.52 85.7 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.562 -0.828 . . . . 0.0 111.583 178.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.621 ' HB3' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -174.3 29.07 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.92 0.39 . . . . 0.0 110.702 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.705 HG21 HG13 ' A' ' 115' ' ' VAL . 65.8 mt -80.43 -93.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.406 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.855 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -50.67 -40.77 54.54 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.444 -178.925 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.503 ' HA3' ' HZ1' ' A' ' 88' ' ' LYS . . . -55.08 -31.51 56.12 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.092 -1.051 . . . . 0.0 111.054 178.686 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.748 ' HG2' HG21 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -84.99 -22.75 28.98 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 120.846 0.355 . . . . 0.0 110.155 179.412 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 89' ' ' ILE . 4.4 mm? -61.89 -5.78 2.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.797 ' HA ' HD13 ' A' ' 101' ' ' LEU . 5.1 mp -108.51 26.7 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.166 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.563 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.3 pt-20 -165.93 -0.21 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.314 -179.267 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.935 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.04 -152.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.366 0.603 . . . . 0.0 111.517 -179.993 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.5 t70 -59.44 -3.84 0.5 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.307 177.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.602 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.9 m-20 77.61 -28.73 0.17 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.356 -179.576 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.424 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.3 m -74.03 -26.55 60.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 177.671 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.935 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.4 OUTLIER -81.33 -26.49 35.57 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.454 176.985 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.797 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -74.96 -25.26 58.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.403 176.242 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.459 ' HA ' HD22 ' A' ' 102' ' ' LEU . 1.0 OUTLIER -86.73 -48.43 8.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.214 -179.374 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.516 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -62.76 -42.32 99.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.091 -178.863 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.662 ' HE1' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.49 -33.63 66.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.303 -179.726 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.568 HD21 ' HG ' ' A' ' 70' ' ' LEU . 25.9 mt -86.76 -10.3 53.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.054 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.72 -8.92 15.29 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.735 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.732 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -140.72 133.38 14.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.846 -178.723 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.454 ' O ' HG21 ' A' ' 54' ' ' THR . 60.3 Cg_endo -71.4 3.71 3.41 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.595 2.196 . . . . 0.0 111.803 178.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -126.47 -11.09 6.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -79.06 -46.07 18.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.121 0.486 . . . . 0.0 109.704 177.989 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.86 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.54 -40.47 18.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.205 176.097 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.412 ' HG2' ' N ' ' A' ' 113' ' ' SER . 3.8 ttt180 -80.33 -57.33 3.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.375 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.412 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 42.1 t -53.71 -56.83 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.766 0.317 . . . . 0.0 110.799 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.52 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 7.6 mmtm -54.65 -32.81 59.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.705 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -72.11 -58.32 5.34 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.046 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.31 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.601 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.3 OUTLIER -54.77 -31.47 58.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.113 0.482 . . . . 0.0 110.29 178.552 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -79.95 -32.45 39.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.832 178.408 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.476 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -69.69 -20.81 63.55 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.746 177.468 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.687 HG13 ' ND1' ' A' ' 82' ' ' HIS . 21.5 t -69.48 -47.8 70.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.412 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.494 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -59.3 -25.58 64.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.471 177.03 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.407 ' O ' HG12 ' A' ' 121' ' ' VAL . 6.2 t -86.05 -34.96 8.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.098 178.692 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -67.23 -33.3 75.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.203 178.254 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.58 -27.34 37.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.615 176.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.5 ' C ' ' HB3' ' A' ' 128' ' ' LYS . . . -89.02 8.65 28.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.368 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.415 ' C ' ' HG2' ' A' ' 128' ' ' LYS . 1.7 t60 -125.81 -31.86 2.88 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.158 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -89.35 -63.53 1.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.243 178.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.24 17.03 15.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.055 -177.98 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.818 ' HG3' ' HB3' ' A' ' 130' ' ' ALA . 7.6 ptmt -71.25 -147.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.928 0.394 . . . . 0.0 110.563 178.854 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -81.07 10.31 5.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.406 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.818 ' HB3' ' HG3' ' A' ' 128' ' ' LYS . . . -58.3 -22.01 51.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.376 -178.886 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -83.77 -170.38 3.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.06 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -71.07 -76.73 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.059 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.616 ' HB3' HG23 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.48 119.67 11.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.826 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -86.84 41.54 0.97 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.181 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.616 HG23 ' HB3' ' A' ' 133' ' ' LYS . 0.2 OUTLIER -99.15 166.17 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.972 179.737 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -92.39 62.86 4.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.95 173.27 6.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.98 -179.757 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.91 141.19 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.043 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 13.5 p -100.83 159.93 14.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.034 -179.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -85.61 99.15 2.34 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.543 -179.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.547 ' H ' ' HD2' ' A' ' 142' ' ' PRO . 3.0 t -97.17 -51.81 0.22 Allowed Pre-proline 0 C--N 1.329 -0.298 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -179.838 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.547 ' HD2' ' H ' ' A' ' 141' ' ' VAL . 49.8 Cg_endo -68.68 165.98 27.63 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.153 1.902 . . . . 0.0 112.351 -179.896 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.9 t -104.42 144.49 31.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.948 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.087 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.53 -57.03 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.506 2.137 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.59 -75.4 0.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.901 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -106.9 178.16 22.06 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.546 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -97.35 -36.31 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.748 0.308 . . . . 0.0 110.912 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.21 116.23 28.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.986 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.6 142.25 16.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.087 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 58.45 -165.56 0.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.127 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 130.22 39.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 -179.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.671 ' N ' ' HA ' ' A' ' 11' ' ' PRO . 0.3 OUTLIER -81.08 -49.02 1.05 Allowed Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.744 -179.881 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.671 ' HA ' ' N ' ' A' ' 10' ' ' THR . 80.8 Cg_endo -88.49 168.77 36.61 Favored 'Cis proline' 0 C--N 1.357 1.001 0 C-N-CA 124.551 -1.021 . . . . 0.0 112.662 0.835 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.29 -59.01 2.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.149 180.0 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.6 m -83.5 102.34 9.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.132 -179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -98.64 125.28 43.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.838 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.0 118.04 33.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.011 -179.832 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.664 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 0.3 OUTLIER -99.88 -46.97 0.21 Allowed Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.682 -179.901 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.664 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 19.8 Cg_endo -60.52 -55.43 1.47 Allowed 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.921 1.747 . . . . 0.0 112.487 -179.804 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.95 73.05 10.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.912 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -78.7 144.28 35.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.901 179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -73.91 143.95 45.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -89.25 83.12 6.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.7 -13.27 27.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.062 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.15 9.42 20.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.045 179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.31 110.55 4.04 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.492 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.79 128.77 65.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.768 0.318 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.53 99.96 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.976 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -95.12 141.75 23.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.834 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.47 -15.71 31.74 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.626 2.217 . . . . 0.0 112.315 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.67 51.55 2.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -82.01 -42.77 18.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.823 179.829 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 55.74 57.9 4.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.093 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.455 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -90.99 88.88 7.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.786 179.7 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -97.58 -166.02 1.33 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.05 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.11 108.17 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.227 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -106.46 93.3 8.13 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.794 179.522 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.402 ' HB2' HE21 ' A' ' 37' ' ' GLN . 30.1 Cg_endo -63.05 -69.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.463 2.109 . . . . 0.0 112.204 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.402 HE21 ' HB2' ' A' ' 36' ' ' PRO . 11.1 mm-40 -101.53 -178.28 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.934 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.424 HG11 ' N ' ' A' ' 39' ' ' THR . 10.8 p -81.71 -26.46 9.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 179.795 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.424 ' N ' HG11 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -86.93 100.3 12.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.976 179.955 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.5 36.95 2.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 38.95 40.42 0.45 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.556 -179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -91.86 152.72 43.31 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.871 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -90.95 115.24 2.48 Favored 'Cis proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.756 -1.352 . . . . 0.0 112.429 0.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -86.83 65.11 8.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.981 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.3 m -88.09 150.43 3.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.157 -179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -107.84 7.78 28.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.465 HG21 ' N ' ' A' ' 48' ' ' GLN . 8.1 p -89.94 141.66 14.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.954 179.909 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.465 ' N ' HG21 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -78.9 151.05 31.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 179.996 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -74.25 120.0 6.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.47 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -102.55 138.51 39.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.594 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -69.61 -49.74 20.71 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.414 179.659 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.594 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 20.6 Cg_endo -60.3 147.14 94.84 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.204 1.936 . . . . 0.0 112.234 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.771 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER -92.13 136.08 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.976 -179.561 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.837 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.98 -175.36 1.21 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.647 178.585 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.593 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -50.34 -45.77 55.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.591 -179.687 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.802 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 20.7 m -55.9 -45.45 78.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.8 0.333 . . . . 0.0 110.718 179.854 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.802 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -60.29 -42.91 96.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.377 178.964 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.593 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.68 -46.9 86.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.338 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.46 -9.48 53.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.026 179.65 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.439 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.2 t -82.22 -9.17 59.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.003 -179.615 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.6 ' HB2' ' HB3' ' A' ' 64' ' ' GLN . . . -133.98 58.52 32.18 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.419 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.593 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.1 Cg_exo -54.07 -49.84 15.7 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.531 2.154 . . . . 0.0 113.286 -179.482 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 76.5 Cg_endo -87.23 -8.05 6.66 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.151 1.901 . . . . 0.0 112.768 -179.117 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.6 ' HB3' ' HB2' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -97.0 -79.3 0.46 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.168 -179.472 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.499 ' HB2' ' H ' ' A' ' 66' ' ' GLN . 0.0 OUTLIER -104.92 -93.98 0.35 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.033 -179.507 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.593 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER 74.99 -47.99 0.63 Allowed 'General case' 0 N--CA 1.465 0.285 0 O-C-N 123.524 0.515 . . . . 0.0 111.142 -179.108 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.575 ' CA ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -127.15 26.33 6.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.032 179.686 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -128.34 -53.28 1.28 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.432 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -78.58 20.5 0.43 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.155 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.575 HD23 ' CA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -89.65 -53.43 4.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.168 0.508 . . . . 0.0 110.385 179.698 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.931 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -108.32 18.66 32.85 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.379 -0.915 . . . . 0.0 111.775 178.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.78 -10.59 2.07 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.338 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.53 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.55 -15.38 5.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.571 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.787 HD13 HD13 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -78.13 -12.67 60.01 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.526 179.968 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.666 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.4 t80 -49.64 -54.55 30.13 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.768 -177.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.666 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 26.3 Cg_exo -63.27 -7.88 13.16 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.139 1.892 . . . . 0.0 112.329 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.771 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.1 mm? -98.63 -37.46 9.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.65 -179.178 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.736 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.5 mm -61.1 -42.46 93.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-O 120.717 0.294 . . . . 0.0 110.942 -179.626 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.779 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 7.3 mt-30 -48.88 -18.79 0.31 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.956 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.49 -40.14 18.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.255 179.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.624 ' HE2' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -72.53 -35.47 68.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.347 0.594 . . . . 0.0 110.601 179.674 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.62 ' ND1' HD12 ' A' ' 89' ' ' ILE . 7.2 m170 -121.61 157.44 56.75 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.649 -177.037 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.525 ' HD2' HD11 ' A' ' 85' ' ' LEU . 16.3 Cg_exo -67.29 69.08 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.488 2.126 . . . . 0.0 111.586 179.031 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.779 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.5 OUTLIER 52.41 24.2 2.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.753 -178.252 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.525 HD11 ' HD2' ' A' ' 83' ' ' PRO . 0.0 OUTLIER -76.93 1.97 16.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.168 -179.33 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.736 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.39 -135.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.76 -17.24 11.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.97 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.94 ' HE2' ' HB2' ' A' ' 122' ' ' LEU . 0.1 OUTLIER -155.88 -20.98 0.11 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.756 HD12 HG21 ' A' ' 119' ' ' VAL . 61.2 mt -50.17 -80.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 CA-C-N 117.706 0.23 . . . . 0.0 111.397 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.931 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.1 -40.22 67.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.557 0.217 . . . . 0.0 110.88 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.95 -28.77 61.22 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.581 176.836 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.628 ' O ' HG22 ' A' ' 96' ' ' ILE . 3.3 ttm -75.65 -37.0 60.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 121.474 0.654 . . . . 0.0 109.83 177.35 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.589 HD23 ' N ' ' A' ' 93' ' ' LEU . 4.5 mm? -56.06 -9.63 0.66 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.72 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.74 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.7 mp -105.24 27.09 8.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.363 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -170.19 1.26 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.758 -178.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.993 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.99 -148.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 121.436 0.636 . . . . 0.0 111.42 -179.768 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.601 ' N ' HG12 ' A' ' 96' ' ' ILE . 3.3 t70 -54.38 -9.82 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.799 175.929 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.69 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.6 m120 79.43 -24.1 0.22 Allowed 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.41 -0.813 . . . . 0.0 111.164 -179.696 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -75.51 -28.47 59.15 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.993 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.42 -33.91 63.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.007 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.74 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -65.3 -27.73 68.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.194 178.445 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.58 -48.33 9.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -39.06 90.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.501 -178.527 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.716 ' HE1' HD21 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -57.45 -37.49 72.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.37 -179.365 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.584 ' N ' ' HG3' ' A' ' 104' ' ' MET . 6.6 mt -87.5 -8.52 56.31 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.115 0.483 . . . . 0.0 110.293 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -106.47 -8.4 17.12 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.267 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.771 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.95 133.48 11.61 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.63 0.252 . . . . 0.0 111.557 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.29 3.44 2.54 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.692 2.261 . . . . 0.0 112.207 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.17 -26.0 3.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.23 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.771 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.76 -44.1 94.44 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.223 179.743 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.837 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.2 OUTLIER -47.43 -41.24 19.8 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.471 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.624 ' HA ' ' HE2' ' A' ' 81' ' ' MET . 1.6 ttt180 -79.09 -64.15 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 t -49.18 -54.07 18.2 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.717 0.294 . . . . 0.0 111.134 -178.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 5.4 mmtt -59.38 -28.95 67.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.091 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.586 ' O ' HG23 ' A' ' 119' ' ' VAL . 1.4 t -71.85 -58.41 5.17 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 178.142 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.639 ' HA ' HG22 ' A' ' 119' ' ' VAL . 3.8 t70 -51.24 -36.69 43.09 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.864 0.364 . . . . 0.0 110.869 178.089 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.74 -40.17 69.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.477 179.015 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.462 ' CB ' HD21 ' A' ' 93' ' ' LEU . . . -62.39 -29.82 70.76 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.931 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.756 HG21 HD12 ' A' ' 89' ' ' ILE . 22.4 t -55.49 -50.62 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-O 121.387 0.613 . . . . 0.0 109.822 177.387 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.51 -29.16 34.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.763 177.442 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.46 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 12.3 t -84.6 -31.65 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.898 179.13 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.94 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.36 -43.17 74.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.958 179.503 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.485 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.3 mm-40 -65.37 -30.33 71.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.887 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.443 ' HA ' ' CD ' ' A' ' 128' ' ' LYS . . . -88.65 -1.45 58.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.315 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.496 ' HA ' ' HB1' ' A' ' 130' ' ' ALA . 12.2 t-80 -120.68 -9.73 9.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.64 -178.675 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -65.14 -105.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.929 -179.354 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.3 36.05 1.27 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 111.152 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.443 ' CD ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -96.16 -152.63 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.067 -179.773 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.86 8.23 13.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.79 179.826 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.496 ' HB1' ' HA ' ' A' ' 125' ' ' HIS . . . -88.62 2.01 53.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.914 179.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -88.68 100.23 12.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.989 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.83 78.18 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.862 -179.75 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.02 -65.48 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.872 179.845 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.53 91.61 4.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.069 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.0 t -73.93 132.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.073 -179.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -92.21 -58.35 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.853 179.799 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 2.7 m -88.27 113.94 24.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.664 179.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.65 86.95 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 102.14 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -80.67 -14.31 80.03 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.555 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.5 130.8 32.52 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 120.607 0.242 . . . . 0.0 111.006 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.59 71.45 5.98 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.456 2.104 . . . . 0.0 112.344 -179.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.413 ' H ' HG22 ' A' ' 143' ' ' THR . 2.5 t -97.89 -34.53 10.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.985 -179.674 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.987 -179.872 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.46 121.89 9.05 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.529 2.153 . . . . 0.0 112.188 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.42 ' H ' ' HG ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -98.52 49.21 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.861 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.88 -173.56 24.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.456 179.824 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -79.21 161.37 26.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.774 0.321 . . . . 0.0 110.968 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.3 123.4 23.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.144 -179.902 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.53 17.89 0.54 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.023 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -139.03 9.16 2.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -130.91 -70.76 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.13 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m 57.52 91.18 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.169 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.72 111.13 2.93 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.461 2.107 . . . . 0.0 112.278 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.63 -49.9 9.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.7 m -89.41 162.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.106 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.09 122.73 23.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 52.1 p -90.31 122.36 33.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.1 t -94.14 130.21 34.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.951 179.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.23 -179.21 1.36 Allowed 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.534 2.156 . . . . 0.0 112.249 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.78 135.02 38.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.008 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -148.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.65 179.592 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -162.71 0.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.745 0.307 . . . . 0.0 110.853 179.901 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -63.7 97.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.942 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.91 -169.52 1.89 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.174 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.47 167.27 21.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.86 68.4 2.56 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.515 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.8 m -100.39 77.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.964 0.412 . . . . 0.0 111.114 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 137.53 52.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.997 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.676 ' N ' ' HA ' ' A' ' 28' ' ' PRO . 0.6 OUTLIER -74.09 -49.81 5.49 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.602 179.934 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.676 ' HA ' ' N ' ' A' ' 27' ' ' ASN . 92.0 Cg_endo -90.13 -44.91 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 124.571 -1.012 . . . . 0.0 112.843 0.665 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -79.82 140.64 36.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.22 164.83 24.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -123.1 46.58 2.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.981 -179.737 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.66 -16.18 20.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.886 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -82.03 -164.96 0.88 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.89 -167.49 0.2 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.666 ' N ' ' HA ' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -90.7 -50.95 0.33 Allowed Pre-proline 0 CA--C 1.536 0.433 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.612 -179.818 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.666 ' HA ' ' N ' ' A' ' 35' ' ' GLN . 67.7 Cg_endo -94.27 -163.97 1.26 Allowed 'Cis proline' 0 C--N 1.355 0.888 0 C-N-CA 124.723 -0.949 . . . . 0.0 112.684 0.658 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -71.01 126.65 30.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.977 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.9 t -76.51 90.62 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.029 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.82 103.14 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 179.98 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.445 ' HB3' ' H ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -85.32 -89.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.998 -179.908 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.445 ' H ' ' HB3' ' A' ' 40' ' ' MET . 0.0 OUTLIER -63.3 112.99 2.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.028 -179.808 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -64.84 146.62 98.61 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.019 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.29 86.66 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.0 112.233 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.56 145.59 36.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.143 -179.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 t -98.67 81.72 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.067 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -107.92 0.56 22.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.927 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.94 155.84 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.017 -179.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.24 35.0 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -77.03 -30.64 55.23 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.496 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -105.83 149.01 26.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.99 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -73.28 124.46 90.56 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.031 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.486 ' O ' ' HG2' ' A' ' 57' ' ' MET . 34.3 Cg_exo -62.25 150.4 87.12 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.684 2.256 . . . . 0.0 112.399 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.693 ' HB2' HD11 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -72.14 135.94 46.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.121 179.725 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.85 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.42 -178.2 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.325 178.026 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -50.19 -38.39 39.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.645 -179.134 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.463 ' HB2' ' HE3' ' A' ' 57' ' ' MET . 1.0 OUTLIER -64.1 -48.91 74.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.843 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.486 ' HG2' ' O ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -58.13 -40.23 80.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.296 0.569 . . . . 0.0 110.357 179.377 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.623 ' HA ' ' HE2' ' A' ' 69' ' ' MET . 13.3 mt -64.08 -45.0 90.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.98 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.82 -7.66 29.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.567 178.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 57' ' ' MET . 21.5 t -83.77 -5.23 59.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.768 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.497 ' HB2' ' HB2' ' A' ' 64' ' ' GLN . . . -133.05 56.85 23.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.353 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.639 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 51.5 Cg_exo -54.56 -52.65 7.65 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.432 2.088 . . . . 0.0 113.225 -179.082 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 66.7 Cg_endo -96.15 21.91 0.42 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.501 2.134 . . . . 0.0 112.544 -179.329 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.497 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 23.5 mt-30 -130.72 -98.0 0.33 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.629 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.649 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -104.6 38.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.676 -177.964 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.622 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.54 -30.68 71.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.297 178.594 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.92 40.21 3.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.407 179.3 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.567 ' N ' HD21 ' A' ' 70' ' ' LEU . 52.0 tt0 -138.01 -52.71 0.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.972 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.649 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 3.7 ptt? -81.7 6.52 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -176.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.05 -59.08 5.28 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.257 0.551 . . . . 0.0 110.2 -179.82 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.759 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -116.91 32.53 5.44 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.201 -1.0 . . . . 0.0 112.697 -179.183 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -141.09 -1.06 1.4 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.733 0.301 . . . . 0.0 111.27 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.509 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.26 -23.04 3.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.092 0.472 . . . . 0.0 110.057 179.343 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.656 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.5 -22.42 54.5 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.663 178.62 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.453 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -40.09 -55.26 4.02 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.241 -177.952 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 59.5 Cg_endo -72.4 -16.04 27.8 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.04 1.826 . . . . 0.0 112.596 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.693 HD11 ' HB2' ' A' ' 53' ' ' LEU . 50.6 mt -92.84 -21.1 20.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.603 -179.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.774 HG13 ' HB ' ' A' ' 90' ' ' THR . 10.3 mm -73.15 -38.94 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.713 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 0.2 OUTLIER -52.08 -17.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.04 177.724 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.38 41.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.864 178.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.69 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -71.42 -45.01 63.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.538 -179.96 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.789 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 5.4 m-70 -115.45 139.95 25.28 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.382 -179.979 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -50.5 82.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.53 2.154 . . . . 0.0 112.147 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.713 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 73.5 p 43.72 40.04 2.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.163 -178.837 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.789 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -97.17 6.28 48.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.183 -179.477 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.617 ' HB3' ' HB ' ' A' ' 78' ' ' ILE . . . -81.07 56.31 2.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.106 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.91 -8.56 75.83 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.151 177.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.618 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -177.65 31.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.394 179.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.722 HG21 HG11 ' A' ' 115' ' ' VAL . 80.9 mt -79.66 -89.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.981 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.774 ' HB ' HG13 ' A' ' 78' ' ' ILE . 0.5 OUTLIER -51.66 -42.46 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.448 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.47 -30.65 50.32 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.014 -1.089 . . . . 0.0 110.919 178.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.69 ' HG3' HG21 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -83.8 -23.58 31.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.452 -0.374 . . . . 0.0 110.199 178.941 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.63 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.2 mm? -60.72 -10.61 5.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.91 179.052 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.723 ' HA ' HD11 ' A' ' 101' ' ' LEU . 6.5 mp -105.68 27.17 8.7 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 176.755 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.609 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -166.03 -0.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.699 -178.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.983 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.44 -150.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.508 0.67 . . . . 0.0 111.727 -179.389 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.58 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -55.09 -8.43 0.28 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.851 175.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.757 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 80.08 -31.13 0.13 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.942 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.7 m -67.94 -29.17 68.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.834 178.44 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.983 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -76.08 -34.96 59.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.757 177.255 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.723 HD11 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -64.62 -30.15 71.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.913 178.263 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.67 -47.75 11.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.362 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -42.2 95.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.494 -178.132 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.711 ' HE2' HD21 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.17 -34.9 66.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.505 -179.123 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 12.8 mt -85.84 -11.04 54.39 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.937 -179.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.53 -4.83 15.99 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.781 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -143.56 133.52 11.92 Favored Pre-proline 0 C--N 1.331 -0.207 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.948 -179.245 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 12.8 Cg_exo -70.73 1.13 5.38 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.98 2.453 . . . . 0.0 111.946 179.316 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' A' ' 113' ' ' SER . 76.7 mt-10 -125.56 -11.48 6.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.537 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.781 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.04 -44.98 24.88 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.142 0.496 . . . . 0.0 109.733 177.908 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.85 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.77 -41.92 24.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.25 176.07 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.66 -61.14 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.551 -179.499 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.55 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.96 -53.23 20.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.809 0.338 . . . . 0.0 111.224 -178.895 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 71.4 mmtt -60.59 -29.74 69.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.018 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.722 HG11 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.81 -56.01 11.65 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.253 178.774 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.524 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -53.88 -35.36 61.49 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 110.512 178.761 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -38.88 63.29 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.28 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 93' ' ' LEU . . . -62.36 -22.56 66.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.749 HG13 ' ND1' ' A' ' 82' ' ' HIS . 19.1 t -68.37 -49.01 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-O 121.084 0.469 . . . . 0.0 109.831 177.022 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.46 -27.17 65.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.389 177.149 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.564 HG12 ' HE2' ' A' ' 92' ' ' MET . 8.5 t -83.88 -30.8 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.464 179.097 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.656 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -76.07 -33.52 59.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.824 178.804 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -67.54 -33.43 75.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.862 178.442 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 128' ' ' LYS . . . -77.48 -76.62 0.17 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.549 177.8 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.411 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.4 OUTLIER -29.34 -39.77 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.91 0.756 . . . . 0.0 112.47 -177.836 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 124' ' ' ALA . 24.9 mm100 -64.57 -80.3 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.292 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.39 30.35 2.57 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.371 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.84 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -96.14 -158.31 0.65 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 0.0 111.043 178.793 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.71 20.58 2.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.582 177.161 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.84 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -60.65 -32.72 71.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.208 -178.474 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.31 100.35 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.272 -179.373 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.451 ' H ' ' HG3' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -97.61 34.99 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.666 179.515 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.34 172.81 1.78 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.12 -179.866 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -85.5 -166.91 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 17.0 m -75.35 155.31 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.14 -179.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -84.14 -111.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.789 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.9 114.08 28.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.804 0.335 . . . . 0.0 110.892 179.973 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -75.86 151.27 37.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.054 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.7 t -88.54 148.68 24.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.932 179.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -103.61 -151.09 22.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.8 m -84.55 146.49 47.16 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.466 0.174 . . . . 0.0 111.126 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.545 ' HB2' HG22 ' A' ' 144' ' ' VAL . 88.6 Cg_endo -80.82 178.9 30.35 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.443 -1.482 . . . . 0.0 112.445 0.126 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.11 14.55 29.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.925 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . 0.545 HG22 ' HB2' ' A' ' 142' ' ' PRO . 6.1 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.045 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -60.3 159.7 25.93 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.668 2.245 . . . . 0.0 112.195 -179.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.5 110.72 22.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.931 179.889 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.1 -161.99 27.64 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.482 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.43 21.44 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.799 0.333 . . . . 0.0 111.119 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.07 -160.07 0.24 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.148 179.841 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.55 -2.4 0.14 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.234 -179.815 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.72 -59.29 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.151 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 59.92 -172.69 0.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.19 -179.729 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.58 135.05 26.93 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.038 -179.82 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 100.18 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.665 2.243 . . . . 0.0 112.212 -179.906 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.7 7.71 16.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.082 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -90.78 139.88 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 -179.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.32 104.17 10.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.905 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.7 p -104.56 95.92 6.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.021 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.41 109.69 45.89 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.825 179.674 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.7 101.94 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.638 2.225 . . . . 0.0 112.373 -179.489 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -96.35 62.74 2.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.762 179.594 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -69.55 -163.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.194 -179.563 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -72.2 164.18 26.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.999 -179.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -90.12 -15.8 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.923 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.05 -74.69 0.25 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.105 -179.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.9 55.78 3.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.069 -179.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.42 -63.29 0.69 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.582 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.34 97.55 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 111.097 179.922 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.0 tpt85 -91.89 -11.69 35.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 179.844 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -94.87 131.74 29.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.35 -14.18 37.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.715 2.277 . . . . 0.0 112.198 -179.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -77.79 103.05 7.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.92 -179.904 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.539 ' HB3' HD13 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -99.66 -14.15 19.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.946 179.873 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 55.74 44.91 25.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.809 -179.906 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.539 HD13 ' HB3' ' A' ' 30' ' ' GLN . 4.1 mt -85.77 160.74 19.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.879 179.885 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -101.99 160.58 14.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.906 -179.843 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 128.44 35.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 -179.873 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -99.98 140.48 21.55 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.995 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.04 -10.59 15.19 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.202 . . . . 0.0 112.288 179.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -80.78 -165.65 0.94 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -77.89 138.88 19.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.097 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.71 -6.75 51.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.901 -179.948 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.9 ttt -89.61 90.57 8.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.836 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.87 127.48 56.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.975 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.497 ' N ' ' HD2' ' A' ' 43' ' ' PRO . 60.5 mt-30 -93.76 -51.26 0.26 Allowed Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.397 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 42' ' ' GLN . 57.9 Cg_endo -70.83 86.27 0.74 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.119 1.88 . . . . 0.0 112.356 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.19 134.03 38.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -86.82 13.34 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -98.75 -7.52 27.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.971 179.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.0 t -107.03 39.12 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.971 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -87.22 8.93 21.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.916 179.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -90.41 18.9 46.88 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.436 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -97.23 138.11 35.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.806 0.336 . . . . 0.0 110.999 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 15.3 mt-10 -85.31 130.67 50.79 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 51' ' ' GLU . 32.5 Cg_exo -59.66 128.81 28.32 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.558 2.172 . . . . 0.0 112.211 -179.988 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.758 ' HB3' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -81.72 136.26 35.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.816 179.844 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.751 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -167.83 179.37 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.372 179.521 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -46.5 -44.51 17.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.664 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -46.64 82.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.729 179.921 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.483 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.09 -42.36 85.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.898 178.565 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -61.12 -42.23 98.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.417 178.583 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -17.29 48.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.507 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.9 t -69.7 -22.05 63.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.117 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.776 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.17 65.93 74.3 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.838 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.652 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.9 Cg_exo -53.56 -52.36 8.75 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.652 2.235 . . . . 0.0 113.204 -178.668 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.647 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.4 Cg_endo -96.34 23.02 0.36 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.506 2.138 . . . . 0.0 112.451 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.565 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 15.9 mm-40 -132.29 -88.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.878 -178.455 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.825 ' HG3' ' HG2' ' A' ' 69' ' ' MET . 1.1 pt-20 -106.92 33.56 3.89 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.983 0.421 . . . . 0.0 111.682 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.652 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -75.71 -27.82 58.36 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.028 179.318 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -126.85 31.01 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 -179.607 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -132.46 -55.93 0.96 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.712 -179.523 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.825 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 2.8 ptt? -80.9 28.12 0.36 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.563 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -89.87 -47.38 7.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.24 0.543 . . . . 0.0 109.956 178.834 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.727 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -110.79 12.62 29.78 Favored Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 177.658 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -127.51 0.53 6.24 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.722 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.49 -31.56 2.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.787 -0.188 . . . . 0.0 111.325 -179.706 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.845 ' HB2' HG22 ' A' ' 90' ' ' THR . 2.9 mm? -57.62 -27.15 62.52 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.127 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.474 ' HB3' ' CD ' ' A' ' 76' ' ' PRO . 9.2 t80 -38.41 -62.12 0.75 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.003 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.614 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 30.0 Cg_endo -62.19 -14.81 40.29 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.897 1.731 . . . . 0.0 112.312 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.662 ' HG ' ' H ' ' A' ' 53' ' ' LEU . 2.1 mm? -96.73 -25.99 15.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.866 -178.685 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.663 HG12 ' O ' ' A' ' 74' ' ' LEU . 7.3 mm -70.88 -46.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 CA-C-O 120.845 0.355 . . . . 0.0 110.758 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.927 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 21.4 mt-30 -50.11 -19.22 0.7 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.543 178.876 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.61 -37.71 27.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.961 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -74.87 -37.27 62.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.757 -179.838 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.746 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -124.49 150.62 65.19 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.605 -179.526 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.453 ' O ' HD12 ' A' ' 85' ' ' LEU . 31.2 Cg_exo -58.27 79.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.438 2.092 . . . . 0.0 111.641 179.036 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.927 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 13.1 t 40.35 36.62 0.36 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.368 -178.3 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -86.13 2.63 45.99 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.072 -179.87 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD13 ' A' ' 89' ' ' ILE . . . -66.75 -141.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.409 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.66 -7.16 59.22 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.816 -179.132 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.582 ' HB3' HD11 ' A' ' 122' ' ' LEU . 0.8 OUTLIER -161.98 -25.24 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.748 -0.226 . . . . 0.0 111.527 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.668 HG21 HG12 ' A' ' 115' ' ' VAL . 61.8 mt -49.14 -81.97 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -178.39 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.845 HG22 ' HB2' ' A' ' 74' ' ' LEU . 0.3 OUTLIER -56.74 -37.21 70.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.821 -179.828 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.72 -28.33 56.69 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 177.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.61 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.1 ttp -77.23 -34.67 55.93 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.33 0.586 . . . . 0.0 109.797 177.17 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HG22 ' A' ' 96' ' ' ILE . 4.5 mm? -58.27 -9.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.591 -178.264 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.604 HD13 HD11 ' A' ' 101' ' ' LEU . 1.5 mm? -104.31 26.75 8.51 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.751 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -171.36 1.03 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.031 -178.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.987 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.66 -148.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.466 0.651 . . . . 0.0 111.696 -179.239 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.598 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.6 t0 -54.24 -9.67 0.3 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.863 176.167 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.668 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.7 m120 79.66 -22.07 0.3 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -78.29 -25.33 46.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.058 0.456 . . . . 0.0 109.791 177.407 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.987 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -78.72 -25.44 44.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.817 177.327 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.694 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.9 tp -74.66 -27.24 60.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.094 178.491 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.48 -45.67 9.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.829 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.452 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.7 t-80 -62.85 -47.03 85.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.166 -178.92 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.897 ' HE2' HD23 ' A' ' 111' ' ' LEU . 7.1 ptm -52.59 -35.71 54.74 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.536 -178.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.57 HD22 ' HB3' ' A' ' 70' ' ' LEU . 25.1 mt -83.57 -11.92 56.75 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.963 -178.695 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -108.33 -11.56 15.18 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.715 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.461 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.15 137.05 17.53 Favored Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.981 -178.941 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.458 ' O ' HG22 ' A' ' 54' ' ' THR . 6.5 Cg_exo -73.63 2.22 6.07 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.941 2.427 . . . . 0.0 111.923 179.433 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -121.42 -16.01 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.546 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.478 ' HG ' ' HA ' ' A' ' 104' ' ' MET . 3.3 p -74.66 -51.22 14.98 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.007 0.432 . . . . 0.0 109.859 178.612 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.897 HD23 ' HE2' ' A' ' 104' ' ' MET . 0.1 OUTLIER -46.78 -38.77 10.61 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.319 177.429 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.598 ' HA ' ' HE2' ' A' ' 81' ' ' MET . 16.1 ttt180 -81.05 -65.42 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.242 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 74.9 m -47.63 -54.5 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.785 0.326 . . . . 0.0 111.22 -178.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 118' ' ' ALA . 9.0 mmtt -58.89 -33.06 70.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.132 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.668 HG12 HG21 ' A' ' 89' ' ' ILE . 1.3 t -70.61 -55.03 15.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.625 ' HA ' HG21 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -52.06 -40.1 60.63 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.89 178.174 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -73.58 -34.9 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.24 178.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 114' ' ' LYS . . . -66.6 -24.15 66.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.961 178.016 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.746 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -63.5 -51.46 70.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 176.61 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.6 -24.67 34.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.538 176.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 121' ' ' VAL . 34.7 t -84.63 -32.83 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.924 179.489 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.71 -44.23 62.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.023 179.294 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.533 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.0 mm-40 -63.73 -29.5 70.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.986 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.569 ' HB1' ' HB1' ' A' ' 130' ' ' ALA . . . -75.78 -50.74 14.36 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.949 178.276 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -69.15 -18.5 63.95 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.722 -178.289 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -87.65 -45.96 9.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.826 0.346 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.85 -47.43 6.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.731 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.453 ' HG3' ' N ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -96.13 178.89 5.25 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.708 0.766 . . . . 0.0 111.754 -178.199 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.442 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 3.7 pt-20 -90.49 61.82 5.06 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.924 175.84 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.569 ' HB1' ' HB1' ' A' ' 124' ' ' ALA . . . -57.63 -23.27 50.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.503 -177.209 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.76 99.03 6.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.98 179.6 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -78.71 -179.73 6.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -89.71 44.42 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.054 179.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.08 172.86 7.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 25.2 m -80.48 -169.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.059 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.89 150.58 48.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 179.726 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.91 178.58 6.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.84 77.35 8.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.165 179.959 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.79 -51.69 2.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.946 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -105.08 79.05 0.28 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 4.9 p -94.19 131.22 31.93 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.593 0.235 . . . . 0.0 111.041 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.19 103.63 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.476 2.117 . . . . 0.0 112.258 -179.807 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.56 108.38 19.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 -179.97 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 10.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.086 179.921 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.67 -78.78 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.529 2.152 . . . . 0.0 112.316 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp -100.07 -30.81 11.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.87 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.2 111.68 3.56 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.453 -179.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -102.3 41.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.821 0.343 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.81 -167.54 0.13 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.227 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.38 -54.19 4.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.07 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.08 -169.95 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.86 -175.97 3.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.064 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.56 94.03 26.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.901 179.846 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -68.77 127.37 15.29 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.427 2.085 . . . . 0.0 112.26 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.7 -25.99 14.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.912 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.4 111.97 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -100.17 136.86 39.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.999 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t -109.03 137.53 46.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.537 HG21 ' HA ' ' A' ' 17' ' ' PRO . 4.1 p -116.7 129.13 25.51 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.965 179.992 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.537 ' HA ' HG21 ' A' ' 16' ' ' VAL . 2.2 Cg_endo -82.56 176.61 35.32 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.959 -1.267 . . . . 0.0 112.16 0.525 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -100.03 75.59 1.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.727 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -69.07 -23.76 64.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.17 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.14 158.94 15.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.083 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.53 93.58 9.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.788 179.83 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.15 -65.26 1.02 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.067 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.33 131.34 41.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.166 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.03 46.86 3.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.398 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.16 179.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.862 0.363 . . . . 0.0 110.995 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -91.04 -71.19 0.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.859 179.984 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -92.6 131.0 35.12 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.843 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.09 -49.03 17.88 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.557 2.171 . . . . 0.0 112.302 -179.818 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -95.75 81.54 3.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.875 -179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.35 -81.71 0.34 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.68 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -118.91 -12.31 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.965 -179.88 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -76.55 123.76 26.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.965 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.59 142.03 30.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.01 -179.992 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.59 -173.89 3.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.145 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -96.32 108.07 39.51 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.753 179.871 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -63.93 128.19 21.32 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.489 2.126 . . . . 0.0 112.3 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.69 -171.55 2.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.055 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -77.39 -14.24 14.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.7 60.09 5.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.838 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 36.4 mmm -88.72 -169.94 2.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 -179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.92 126.86 30.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.991 -179.759 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.408 ' HA ' ' C ' ' A' ' 43' ' ' PRO . 7.7 pt20 -153.65 130.66 5.83 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 179.752 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.408 ' C ' ' HA ' ' A' ' 42' ' ' GLN . 15.2 Cg_exo -69.69 143.88 74.97 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.748 -1.355 . . . . 0.0 112.297 0.642 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.17 171.47 11.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.151 -179.729 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.412 ' H ' HG21 ' A' ' 45' ' ' VAL . 4.3 m -101.46 2.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.198 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.6 92.13 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.3 m -102.21 -158.52 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.808 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.03 -33.47 74.64 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.6 179.736 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.8 140.75 14.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.352 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -97.34 141.68 30.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 0.0 110.96 179.936 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.61 144.98 98.89 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.58 -168.47 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.495 2.13 . . . . 0.0 112.402 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.713 ' HB2' HD11 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -96.05 152.14 18.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.963 -179.751 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.463 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -168.36 -167.16 0.77 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.106 178.658 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -55.75 -34.5 65.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.51 -178.894 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.506 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 75.2 m -65.0 -51.54 61.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.646 179.569 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.633 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.1 -38.23 76.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.278 179.219 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.655 HD22 HD21 ' A' ' 70' ' ' LEU . 13.2 mt -63.03 -44.64 95.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.575 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.0 -15.99 38.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.96 179.736 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 t -72.76 -5.95 41.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 179.562 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.59 ' HB1' ' HE3' ' A' ' 69' ' ' MET . . . -132.94 61.1 54.22 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.088 179.891 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.594 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 36.1 Cg_exo -58.59 -52.45 5.39 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.567 2.178 . . . . 0.0 113.575 -178.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.594 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 68.7 Cg_endo -89.91 -14.17 2.41 Favored 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.254 1.97 . . . . 0.0 112.951 -178.758 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -86.07 -81.05 0.22 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.176 -179.209 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.647 ' HB3' ' HB3' ' A' ' 68' ' ' GLN . 2.7 mm-40 -103.6 -94.43 0.32 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.107 -179.502 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.439 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER 69.03 -17.32 0.21 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.946 0.403 . . . . 0.0 111.146 -178.918 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HA ' HD22 ' A' ' 70' ' ' LEU . 1.8 mttt -136.62 11.16 3.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.291 178.915 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.647 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.8 tt0 -120.39 -56.55 1.97 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.681 -179.193 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.59 ' HE3' ' HB1' ' A' ' 61' ' ' ALA . 42.8 mtm -60.82 -7.92 2.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -177.572 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.655 HD21 HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -64.73 -48.76 73.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.124 0.488 . . . . 0.0 110.204 -179.124 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.761 ' HA2' HG21 ' A' ' 90' ' ' THR . . . -117.85 14.39 12.76 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.732 178.488 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -128.01 1.58 5.92 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.691 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.54 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.6 tpt180 -126.38 -34.6 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.244 -0.183 . . . . 0.0 110.897 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.761 ' HB2' HG23 ' A' ' 90' ' ' THR . 3.0 mm? -59.14 -35.25 73.17 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 178.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.476 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.0 t80 -35.19 -61.68 0.48 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -174.533 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.54 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 33.8 Cg_endo -63.87 -16.86 57.27 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.057 1.838 . . . . 0.0 112.528 -178.972 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.713 HD11 ' HB2' ' A' ' 53' ' ' LEU . 52.4 mt -98.53 -23.95 15.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.799 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 74' ' ' LEU . 1.6 mm -69.18 -35.78 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-O 120.97 0.414 . . . . 0.0 110.214 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.754 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.1 mt-30 -53.29 -17.32 1.71 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.26 -38.83 20.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.832 178.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.519 ' HE2' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -70.2 -44.85 67.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.126 0.489 . . . . 0.0 110.436 179.549 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.75 ' ND1' HG13 ' A' ' 119' ' ' VAL . 2.0 m-70 -115.75 155.03 48.09 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.227 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.49 ' O ' HD11 ' A' ' 85' ' ' LEU . 24.7 Cg_exo -63.23 75.56 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.47 2.113 . . . . 0.0 111.994 179.538 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.754 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 30.3 p 47.17 45.85 16.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.213 -179.318 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.506 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 2.4 mp -103.39 9.09 38.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.073 -179.636 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.637 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.39 20.95 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.973 -179.219 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.483 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -48.64 -27.35 6.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 178.805 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 92' ' ' MET . 5.0 ttpt -171.9 40.41 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.154 178.823 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.685 HG22 HG11 ' A' ' 115' ' ' VAL . 47.8 mt -79.84 -83.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.649 178.684 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.761 HG21 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.5 -35.9 63.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.418 179.01 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.02 -30.2 60.19 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.219 -1.153 . . . . 0.0 110.219 176.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.636 ' O ' HG23 ' A' ' 96' ' ' ILE . 3.2 ttp -75.14 -36.11 61.61 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.031 -0.585 . . . . 0.0 109.882 176.451 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.617 HD13 ' NZ ' ' A' ' 114' ' ' LYS . 4.6 mm? -59.9 -3.7 0.59 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.582 -177.656 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.718 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.0 mp -109.2 26.16 10.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 175.669 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -170.86 3.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.34 -178.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.815 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.4 -150.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 121.483 0.659 . . . . 0.0 111.619 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.6 t70 -59.58 -2.76 0.38 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.108 177.356 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.611 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.2 m120 77.99 -31.56 0.16 Allowed 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.208 -179.651 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.428 ' H ' ' C ' ' A' ' 97' ' ' ASP . 0.1 OUTLIER -68.51 -35.98 78.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.297 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.815 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.5 mt-10 -68.18 -43.91 77.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.367 177.388 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.718 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -54.76 -21.83 12.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.804 0.335 . . . . 0.0 110.711 177.316 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.406 HD11 ' O ' ' A' ' 98' ' ' ASN . 2.5 mp -92.92 -45.12 8.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.735 -179.197 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.444 ' HB3' ' HG ' ' A' ' 110' ' ' SER . 0.1 OUTLIER -70.24 -30.25 67.27 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.708 -177.839 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.765 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 0.5 OUTLIER -65.19 -34.51 78.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.632 0.253 . . . . 0.0 110.78 179.846 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.476 ' HA ' HD12 ' A' ' 58' ' ' LEU . 5.7 mt -87.13 -12.14 47.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.167 0.508 . . . . 0.0 110.052 178.266 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -105.69 -4.72 20.67 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.083 -176.16 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.874 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.2 t -149.03 133.14 8.76 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.555 -179.415 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.55 8.93 2.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.586 2.191 . . . . 0.0 112.358 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -133.89 -20.51 1.97 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.11 -179.882 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.874 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.2 OUTLIER -64.55 -53.31 49.98 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.208 0.528 . . . . 0.0 109.784 177.73 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.639 ' HG ' ' HE1' ' A' ' 104' ' ' MET . 10.0 tt -47.64 -35.36 9.25 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.175 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.519 ' HA ' ' HE2' ' A' ' 81' ' ' MET . 2.0 ttt-85 -86.63 -52.1 5.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -178.268 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.1 m -52.7 -50.13 63.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.663 -178.019 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.765 ' NZ ' ' HB3' ' A' ' 104' ' ' MET . 0.4 OUTLIER -80.4 -25.65 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.946 -178.533 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.685 HG11 HG22 ' A' ' 89' ' ' ILE . 1.1 t -59.9 -51.34 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.594 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.556 ' HA ' HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -58.23 -34.42 70.42 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.434 177.467 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -77.18 -27.34 53.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.719 178.331 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.621 ' O ' ' HE2' ' A' ' 92' ' ' MET . . . -71.98 -27.74 62.96 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.224 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.75 HG13 ' ND1' ' A' ' 82' ' ' HIS . 16.4 t -58.2 -51.35 72.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.752 176.01 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.53 -28.53 31.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.797 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 121' ' ' VAL . 5.1 t -85.52 -31.03 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.99 179.245 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.466 HD21 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -69.57 -41.75 75.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.9 179.094 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.441 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 82.4 mm-40 -72.49 -24.43 61.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.224 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.35 -6.83 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.189 179.427 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.732 ' HA ' ' HB3' ' A' ' 128' ' ' LYS . 3.9 t60 -113.45 -29.88 7.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.202 -179.481 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -58.72 -75.84 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -93.23 53.53 1.95 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.848 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.732 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . 19.1 pttm -64.95 112.78 3.46 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.043 -175.225 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -86.94 11.75 12.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.215 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -81.41 19.16 1.02 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.381 -179.088 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -82.02 16.52 1.88 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 179.771 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.51 163.24 23.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.22 96.13 8.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.902 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -73.0 122.32 21.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.046 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.77 144.13 11.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.968 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -83.81 77.11 9.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.048 -179.834 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.52 162.93 13.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.9 -26.15 64.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.301 -179.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 4.6 t -103.7 142.62 34.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.036 -179.843 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -107.05 -147.04 13.58 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.47 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.42 ' H ' HG22 ' A' ' 141' ' ' VAL . 3.5 m -98.89 129.95 28.66 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.562 0.22 . . . . 0.0 111.031 179.839 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -80.61 42.31 1.31 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.586 2.191 . . . . 0.0 112.532 -179.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.98 13.78 33.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.83 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.141 -179.896 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -80.57 47.68 2.64 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 -179.66 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.8 mt -84.62 -65.87 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.982 179.92 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.78 -36.22 5.36 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.588 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 m -91.22 84.29 5.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.857 0.36 . . . . 0.0 110.947 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.21 100.43 12.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -98.07 69.98 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.103 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 57.71 -168.28 0.12 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.166 -179.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -129.0 34.85 4.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.135 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.01 132.86 18.37 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.887 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.19 139.38 38.59 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.475 2.117 . . . . 0.0 112.209 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.54 -17.0 56.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.04 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.0 t -102.98 87.01 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.16 136.45 36.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.944 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -103.18 146.4 28.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.991 179.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 m -104.97 137.26 19.16 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.118 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.58 -3.4 13.4 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.512 2.141 . . . . 0.0 112.316 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -75.58 149.93 38.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.864 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -74.97 167.92 20.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.901 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -102.65 118.92 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -69.42 147.11 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.14 95.23 3.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.009 179.989 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.99 105.26 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.082 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -93.49 89.21 1.29 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.618 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.457 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -104.66 -57.45 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.335 . . . . 0.0 111.012 179.641 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.42 ' HG3' ' H ' ' A' ' 27' ' ' ASN . 0.8 OUTLIER -98.5 177.04 5.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.867 179.835 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.472 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 3.6 m120 -88.35 -51.73 0.39 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.368 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 27' ' ' ASN . 16.7 Cg_exo -67.88 83.4 0.43 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.381 2.054 . . . . 0.0 112.066 179.984 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -90.37 -45.2 9.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.946 -179.922 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.02 174.3 9.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.936 179.935 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -133.01 62.33 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.901 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.28 134.57 34.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.915 179.912 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -94.1 -172.71 2.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.89 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.75 122.97 24.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.872 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.618 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 4.9 mm-40 -100.69 -52.04 0.18 Allowed Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.385 -179.971 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.618 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 29.7 Cg_exo -61.72 125.23 16.17 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.182 1.922 . . . . 0.0 112.164 -179.923 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -88.2 153.32 21.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.4 m -89.62 -32.25 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.274 -179.608 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.14 111.01 22.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.4 mtt -91.15 -26.01 19.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.746 179.596 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 58.85 177.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.346 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.12 -53.95 0.04 OUTLIER Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.185 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -64.92 93.2 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.176 1.917 . . . . 0.0 112.046 179.748 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.59 168.05 6.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.107 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.27 100.59 10.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.984 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -95.39 146.43 24.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.979 -179.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 24.1 m -106.53 171.35 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.087 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -90.97 42.96 1.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.792 179.9 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.99 36.18 3.32 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.499 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.55 61.77 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.53 120.63 71.17 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' O ' ' SD ' ' A' ' 57' ' ' MET . 61.5 Cg_endo -73.13 -167.02 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.445 2.097 . . . . 0.0 112.377 -179.668 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.756 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -90.37 146.79 23.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.59 -179.94 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.788 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -166.86 -176.35 3.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.144 0.497 . . . . 0.0 111.999 179.553 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.615 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -53.08 -56.91 12.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.393 -0.822 . . . . 0.0 112.686 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.2 m -47.37 -34.36 6.89 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.105 0.478 . . . . 0.0 110.97 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.655 ' SD ' ' HA ' ' A' ' 53' ' ' LEU . 4.3 mtt -75.35 -41.54 56.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.447 179.141 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.615 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.98 -38.09 69.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.822 176.859 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.22 -23.66 62.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.428 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -68.15 -7.39 29.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.29 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.455 ' HB3' ' HB3' ' A' ' 64' ' ' GLN . . . -133.4 63.57 65.64 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.259 -179.742 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.656 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.3 Cg_exo -55.0 -53.13 6.44 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.514 2.143 . . . . 0.0 113.028 -179.08 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.5 Cg_endo -98.51 22.95 0.26 Allowed 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.539 2.16 . . . . 0.0 112.757 -179.156 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.455 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -128.4 -94.89 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.711 -178.852 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.68 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.12 40.14 1.73 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -177.813 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.563 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -70.92 -23.06 62.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.903 0.382 . . . . 0.0 110.86 179.369 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.515 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.4 28.99 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.966 -179.822 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.08 -52.02 0.84 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.194 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.68 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -78.48 15.89 0.92 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -177.175 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.564 ' O ' HD13 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -89.43 -31.72 17.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.115 0.483 . . . . 0.0 110.591 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.812 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -132.36 10.39 5.31 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.552 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -127.92 -6.17 5.59 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.561 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -126.54 -16.51 5.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.935 0.397 . . . . 0.0 110.565 179.354 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.72 -16.75 58.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.059 178.964 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.717 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 13.8 t80 -49.34 -53.88 35.48 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.924 -177.543 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.717 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.1 Cg_exo -65.73 -6.45 14.0 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.149 1.9 . . . . 0.0 112.494 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.642 HD22 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.78 -38.68 8.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.635 -179.274 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.614 HD12 HG22 ' A' ' 115' ' ' VAL . 4.8 mm -60.0 -40.47 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.883 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.888 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 31.0 mt-30 -47.66 -21.45 0.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.796 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.11 -44.03 17.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.848 178.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.444 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -66.78 -43.14 84.75 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.302 0.572 . . . . 0.0 110.225 179.187 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.51 ' CE1' ' CG2' ' A' ' 119' ' ' VAL . 4.7 m170 -121.52 143.99 39.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.456 -177.729 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.53 80.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.563 2.175 . . . . 0.0 112.254 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.888 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 61.9 p 43.32 32.72 0.51 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.196 -179.115 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.491 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -88.34 6.93 34.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.09 -179.367 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.607 ' HB1' ' HB ' ' A' ' 78' ' ' ILE . . . -71.59 20.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.882 -179.422 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.491 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -54.26 -22.62 22.88 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.834 -179.933 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.615 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.0 OUTLIER -165.46 28.76 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.0 111.216 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.688 HG22 HG23 ' A' ' 119' ' ' VAL . 60.8 mt -80.42 -88.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.386 -0.525 . . . . 0.0 110.817 179.019 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.812 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.02 -41.5 59.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.279 -179.943 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.67 -31.13 57.48 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.068 -1.063 . . . . 0.0 111.055 178.497 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.652 ' O ' HG23 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -83.43 -23.29 32.37 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 178.685 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.654 ' HA ' HG22 ' A' ' 96' ' ' ILE . 4.4 mm? -61.63 -7.53 3.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.631 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.772 ' HA ' HD11 ' A' ' 101' ' ' LEU . 4.6 mp -106.66 26.26 10.2 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.571 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.7 pt-20 -167.08 1.87 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.33 -178.608 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.946 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -151.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 121.334 0.587 . . . . 0.0 111.697 -179.702 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.566 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 0.8 OUTLIER -59.04 -3.56 0.37 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.998 177.949 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.566 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 34.3 m-80 79.19 -28.65 0.15 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.524 179.536 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -31.22 60.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.09 0.471 . . . . 0.0 109.877 178.201 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.946 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -75.42 -23.32 56.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.937 177.863 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.772 HD11 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -75.1 -25.62 58.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.862 177.031 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mp -87.15 -49.38 7.33 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.984 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.482 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.3 t-80 -59.49 -46.97 87.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.709 -179.548 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.778 ' HE2' HD23 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -53.2 -36.51 61.05 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -178.169 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.557 ' N ' ' HG3' ' A' ' 104' ' ' MET . 6.9 mt -86.64 -5.5 59.11 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.342 0.592 . . . . 0.0 110.071 179.1 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -110.44 -8.09 14.71 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.001 -175.026 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.464 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.4 OUTLIER -146.25 142.0 17.09 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.061 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.64 ' HA ' HG22 ' A' ' 54' ' ' THR . 7.5 Cg_exo -73.2 -0.57 9.34 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 179.437 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -124.43 -19.38 5.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.568 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.531 ' HG ' ' H ' ' A' ' 111' ' ' LEU . 4.4 p -63.74 -50.53 68.71 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.233 0.54 . . . . 0.0 109.79 178.169 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -46.49 -29.24 1.67 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.118 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.457 HH21 ' HG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -92.59 -63.42 1.23 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.985 -179.858 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.544 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 43.5 m -49.31 -30.21 7.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.958 179.15 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.489 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.0 mmtm -80.84 -41.22 23.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.844 178.093 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.614 HG22 HD12 ' A' ' 78' ' ' ILE . 2.0 t -66.43 -62.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.124 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.614 ' HA ' HG22 ' A' ' 119' ' ' VAL . 5.3 t0 -48.67 -36.13 15.37 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.644 0.259 . . . . 0.0 111.258 178.608 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 113' ' ' SER . 7.4 mt-10 -74.05 -41.14 62.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.818 0.342 . . . . 0.0 110.514 179.114 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.44 -21.77 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.691 178.057 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.688 HG23 HG22 ' A' ' 89' ' ' ILE . 59.1 t -66.79 -46.43 85.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.866 177.412 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.16 -26.57 66.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.506 176.652 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.505 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 11.2 t -85.32 -32.08 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.579 179.057 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.595 HD12 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.79 -35.77 70.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.825 179.004 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -71.97 -28.52 63.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.114 178.33 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.88 -6.32 57.39 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.235 179.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.51 ' HA ' ' HB1' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -122.05 8.35 9.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.561 -178.808 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 20.1 mt-30 -75.43 -105.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.611 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.42 26.56 3.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.85 0.357 . . . . 0.0 110.998 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.17 -148.7 0.3 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.055 -179.196 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.04 49.2 1.77 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.074 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.51 ' HB1' ' HA ' ' A' ' 125' ' ' HIS . . . -88.71 19.29 4.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.62 -1.15 41.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.739 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.83 108.59 9.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.905 179.896 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 9.8 mttp -66.64 -27.22 67.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.006 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.38 157.67 35.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 -179.988 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.2 m -95.84 173.05 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.151 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -66.36 157.61 31.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.941 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.46 132.8 42.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.986 -179.973 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -77.84 92.26 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.068 179.897 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 72.8 p -102.53 -12.34 17.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.917 -179.942 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -87.92 -66.93 1.31 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.545 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' A' ' 142' ' ' PRO . 5.2 t -100.86 129.96 26.27 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.476 0.179 . . . . 0.0 110.954 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.461 ' HA ' HG12 ' A' ' 141' ' ' VAL . 85.9 Cg_endo -82.22 165.82 71.73 Favored 'Cis proline' 0 C--N 1.349 0.557 0 C-N-CA 123.562 -1.432 . . . . 0.0 112.483 0.228 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 77.7 p -85.83 -172.32 4.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.076 179.899 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.526 -0.23 . . . . 0.0 112.526 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.07 -32.12 64.6 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.564 2.176 . . . . 0.0 112.137 179.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.6 mt -98.59 177.09 5.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.962 179.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.77 -62.16 0.68 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.514 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -103.52 154.21 19.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.342 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -145.8 47.04 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.004 -179.994 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.7 -3.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.17 -179.872 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -159.53 -13.95 0.06 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.995 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 59.11 -91.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.205 -179.887 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.1 m 64.91 124.04 0.02 OUTLIER Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.251 179.774 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.65 170.88 65.87 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.545 -1.44 . . . . 0.0 112.419 -0.036 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.18 -46.24 11.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.001 179.847 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.431 ' H ' HG22 ' A' ' 13' ' ' VAL . 9.4 m -81.07 174.72 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.097 179.858 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 14' ' ' ARG . 3.6 mtp180 -98.82 84.6 3.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -111.85 21.29 16.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.583 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 35.1 m -92.24 -29.5 0.31 Allowed Pre-proline 0 CA--C 1.54 0.57 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 16' ' ' VAL . 25.4 Cg_exo -63.6 176.89 1.97 Allowed 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.747 1.631 . . . . 0.0 112.12 -179.834 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -75.81 -168.78 0.94 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.969 -179.955 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -63.64 106.04 0.9 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 109.91 22.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.026 179.956 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -77.43 82.67 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.806 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.31 130.26 35.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.161 -179.655 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.43 120.11 15.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.009 179.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.26 52.29 1.08 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.569 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.402 HG11 ' N ' ' A' ' 26' ' ' ARG . 8.0 p -86.45 -31.66 6.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.402 ' N ' HG11 ' A' ' 25' ' ' VAL . 66.5 mtm180 -88.87 108.07 19.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.909 179.862 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -90.42 144.77 31.32 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.86 23.02 0.58 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.529 2.152 . . . . 0.0 112.645 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -72.9 102.09 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.864 179.766 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.437 ' NE2' ' HB2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -92.66 -79.74 0.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.07 -179.681 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 54.66 49.17 18.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 -179.83 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HB2' ' NE2' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -78.28 117.71 19.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.017 -179.737 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.21 72.85 7.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.668 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.71 76.44 5.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.16 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.51 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 1.1 tm0? -83.01 -51.05 0.69 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 54.3 Cg_endo -69.0 -17.89 40.84 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.199 1.933 . . . . 0.0 112.169 179.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.95 109.33 10.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -97.62 90.81 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 179.921 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -109.17 -56.92 2.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.987 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.33 168.19 11.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.981 -179.896 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -85.79 154.0 21.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.967 179.987 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -117.96 91.09 38.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.51 126.88 23.78 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.64 2.227 . . . . 0.0 112.302 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.72 90.36 8.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.045 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -101.5 92.84 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.115 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -82.27 105.36 13.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 -179.895 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 6.3 p -109.95 19.31 6.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.114 0.483 . . . . 0.0 110.893 -179.882 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.35 -34.51 76.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.742 179.579 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.91 79.58 1.85 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.322 179.617 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.71 104.12 14.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.807 0.337 . . . . 0.0 111.017 -179.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.614 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 2.2 mt-10 -75.34 -49.16 4.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.448 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 18.4 Cg_endo -58.07 144.99 93.92 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.215 1.944 . . . . 0.0 112.241 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.799 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -83.07 148.11 27.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.95 -179.828 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -163.62 -171.95 2.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.489 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 104' ' ' MET . . . -53.73 -36.88 62.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.192 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.523 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.2 m -60.95 -46.01 92.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.799 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.66 -43.22 89.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.056 178.325 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -57.77 -48.23 80.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.572 178.973 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.37 -3.21 19.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.367 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.448 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 8.4 t -87.23 -6.77 58.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.074 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.61 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.7 53.98 11.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.675 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.61 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 88.5 Cg_endo -103.21 114.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.018 2.479 . . . . 0.0 113.241 -178.53 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 91.4 Cg_endo -101.11 132.11 1.71 Allowed 'Cis proline' 0 N--CA 1.456 -0.706 0 C-N-CA 124.574 -1.011 . . . . 0.0 112.388 -0.205 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.43 ' HB3' ' H ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -173.23 -86.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.738 0.304 . . . . 0.0 111.211 179.792 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.619 ' HB2' ' HE2' ' A' ' 69' ' ' MET . 4.4 mm-40 -94.19 8.13 42.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.999 -179.249 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -48.32 66.08 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.648 179.406 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HA ' HD22 ' A' ' 70' ' ' LEU . 5.4 ptpt -116.18 40.65 2.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.888 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.609 ' N ' HD12 ' A' ' 70' ' ' LEU . 10.0 mt-30 -139.23 -54.54 0.58 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.721 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.619 ' HE2' ' HB2' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -81.08 3.07 24.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.849 -178.889 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.747 HD11 ' H ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -69.97 -39.33 76.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 0.0 111.085 179.765 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.84 ' HA2' HG22 ' A' ' 90' ' ' THR . . . -135.34 24.96 3.34 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.236 -0.983 . . . . 0.0 112.87 -179.504 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -138.09 -5.42 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.564 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.28 -20.85 4.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.873 -179.825 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.689 ' HG ' HD21 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -74.83 -13.09 60.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.692 -178.748 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.712 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 8.4 t80 -48.32 -56.71 13.06 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.703 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.712 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 24.5 Cg_exo -63.29 -11.7 26.77 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.042 1.828 . . . . 0.0 112.046 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -94.79 -28.35 15.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.462 -179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.756 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -67.78 -39.64 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.013 -179.608 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.858 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -50.47 -20.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 110.125 178.682 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.75 -40.87 24.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.449 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.756 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.44 -50.75 28.7 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.184 0.516 . . . . 0.0 110.52 -179.62 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.776 ' ND1' HG12 ' A' ' 119' ' ' VAL . 2.0 m-70 -111.49 151.61 43.39 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.491 -179.673 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.418 ' O ' HD23 ' A' ' 85' ' ' LEU . 18.8 Cg_endo -59.53 81.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.387 2.058 . . . . 0.0 111.798 179.555 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.858 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.0 t 42.13 31.0 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.532 -178.776 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.62 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -80.45 2.22 26.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.585 ' HA ' HD11 ' A' ' 89' ' ' ILE . . . -66.01 -144.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.971 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.72 -15.62 50.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.69 -179.114 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.79 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.1 tptt -156.46 -22.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.642 HD13 HG21 ' A' ' 119' ' ' VAL . 68.4 mt -49.25 -86.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -177.491 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.84 HG22 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.97 -41.83 64.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.276 -178.599 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.461 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.27 -31.45 50.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.217 178.463 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.79 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.79 -25.06 30.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.885 0.374 . . . . 0.0 110.323 179.185 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.579 HD22 ' O ' ' A' ' 89' ' ' ILE . 4.1 mm? -59.08 -10.86 2.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.417 178.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.696 HD11 HD21 ' A' ' 101' ' ' LEU . 3.8 mp -101.89 25.97 8.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.728 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.531 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -169.1 1.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.154 -177.614 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.991 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.42 -148.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.41 0.624 . . . . 0.0 111.408 -179.417 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.589 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.2 t70 -54.33 -9.42 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.824 176.081 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.701 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 79.88 -23.1 0.25 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.138 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -32.74 58.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.408 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.991 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -69.65 -34.64 74.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.049 177.545 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.696 HD21 HD11 ' A' ' 94' ' ' LEU . 2.3 tm? -65.9 -28.73 69.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.274 178.741 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.15 -49.85 9.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.911 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.474 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 1.5 t-80 -58.79 -48.44 81.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.958 -178.888 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.689 ' HE2' HD23 ' A' ' 111' ' ' LEU . 0.9 OUTLIER -52.29 -35.5 50.56 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.157 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.734 HD22 HD23 ' A' ' 70' ' ' LEU . 17.5 mt -84.8 -8.78 58.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 0.0 110.791 -179.404 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.474 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.06 -7.33 16.14 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.615 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.409 ' CB ' ' HG ' ' A' ' 110' ' ' SER . 0.5 OUTLIER -143.13 140.15 17.53 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 120.506 -0.477 . . . . 0.0 112.042 -179.169 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.473 ' O ' HG23 ' A' ' 54' ' ' THR . 60.1 Cg_endo -72.18 3.8 3.77 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.645 2.23 . . . . 0.0 111.991 179.07 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -128.72 -19.01 3.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.416 ' HB3' ' ND1' ' A' ' 103' ' ' HIS . 4.9 p -64.22 -49.86 70.29 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.356 0.598 . . . . 0.0 109.675 177.447 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.95 -26.78 1.07 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.783 178.05 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.432 ' HG2' ' HE1' ' A' ' 81' ' ' MET . 54.0 mtp180 -95.94 -65.69 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.78 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 5.0 m -46.12 -30.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.296 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.757 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 69.4 mmtt -80.44 -42.44 22.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.697 177.819 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.551 HG21 ' HG ' ' A' ' 93' ' ' LEU . 2.2 t -66.06 -60.37 2.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.874 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.535 ' HA ' HG22 ' A' ' 119' ' ' VAL . 5.3 t70 -48.0 -38.9 18.14 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.31 178.679 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.476 ' HB2' ' O ' ' A' ' 113' ' ' SER . 1.9 mt-10 -76.87 -33.27 57.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.271 179.466 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.616 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -67.55 -26.79 66.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.882 177.958 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.776 HG12 ' ND1' ' A' ' 82' ' ' HIS . 20.0 t -61.52 -51.14 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.05 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.58 32.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.779 177.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.487 ' O ' HG13 ' A' ' 121' ' ' VAL . 14.3 t -85.52 -31.35 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.945 179.546 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.563 HD11 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.53 -41.31 63.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.026 179.363 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 2.2 mm-40 -61.69 -37.96 86.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 178.822 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -65.82 -79.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.352 177.072 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.453 ' HA ' ' HD3' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -31.49 -37.53 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.715 0.634 . . . . 0.0 112.223 -178.61 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 22.0 mt-30 -62.44 -83.38 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 179.256 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.56 31.35 2.3 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.811 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.642 ' HG3' ' N ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -96.22 -160.33 0.79 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.243 0.544 . . . . 0.0 111.18 179.034 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.93 31.55 0.78 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.325 176.594 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.642 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -69.24 5.2 1.33 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.876 -177.613 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.24 13.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.489 -179.432 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -68.46 -20.1 64.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.1 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.37 7.06 15.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.021 -179.776 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -94.45 -39.23 10.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.136 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.3 m -84.53 -5.09 9.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.207 -179.846 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -85.73 123.97 31.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.916 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 48.1 p -86.59 115.4 24.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.021 -179.889 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.82 76.56 8.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.95 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 12.3 t -97.47 20.84 11.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.789 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -78.48 111.57 3.28 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.566 179.975 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.508 HG11 ' HD2' ' A' ' 142' ' ' PRO . 3.0 t -96.28 129.24 34.09 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.511 0.196 . . . . 0.0 110.984 179.935 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.508 ' HD2' HG11 ' A' ' 141' ' ' VAL . 49.8 Cg_exo -55.93 118.7 5.52 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.525 2.15 . . . . 0.0 112.317 -179.828 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 3.6 p -87.72 50.08 1.93 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.1 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.178 179.938 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.143 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.96 168.58 22.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.517 2.145 . . . . 0.0 112.404 -179.851 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.69 138.65 35.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.925 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.15 4.82 45.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.507 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.07 -67.67 0.79 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 110.924 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.47 -166.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.163 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.58 -80.08 0.44 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.171 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -151.55 118.08 5.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.47 27.39 1.72 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.062 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.66 ' N ' ' HA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -78.99 -50.6 1.39 Allowed Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.585 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.66 ' HA ' ' N ' ' A' ' 10' ' ' THR . 68.8 Cg_endo -91.5 -5.78 46.07 Favored 'Cis proline' 0 C--N 1.355 0.917 0 C-N-CA 124.603 -0.999 . . . . 0.0 112.648 0.479 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.55 ' N ' ' HB ' ' A' ' 10' ' ' THR . . . -70.22 94.93 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.034 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.9 t -92.31 92.79 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.056 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -96.36 -60.46 1.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.894 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.535 HG21 ' HD3' ' A' ' 63' ' ' PRO . 5.9 p -103.49 92.34 4.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.837 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.437 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 4.2 p -102.38 126.42 33.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.972 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 28.1 Cg_exo -62.25 -26.2 77.28 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.625 2.217 . . . . 0.0 112.222 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -82.91 163.42 21.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.93 -179.797 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -78.61 172.78 13.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.908 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 65.2 0.94 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.81 179.932 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -74.06 -18.05 60.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.57 -49.91 9.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.092 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.17 114.73 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.095 -179.844 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.627 ' HA3' ' HG2' ' A' ' 28' ' ' PRO . . . -104.08 91.01 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.388 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.639 ' HA ' ' HB2' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -107.32 4.86 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.808 0.337 . . . . 0.0 111.134 -179.665 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -98.51 -72.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.083 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.568 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 10.6 m-80 -90.82 -50.61 0.33 Allowed Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.536 -179.47 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.627 ' HG2' ' HA3' ' A' ' 24' ' ' GLY . 47.5 Cg_exo -57.24 -31.47 90.82 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.192 1.928 . . . . 0.0 112.499 -179.549 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.639 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 0.0 OUTLIER -78.34 -21.98 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.125 -179.664 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -99.41 178.12 4.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.866 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 -98.24 40.02 1.21 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.813 179.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.96 4.36 26.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.973 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 97.47 8.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.857 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.13 58.09 4.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.475 ' HB3' ' HD3' ' A' ' 36' ' ' PRO . 18.6 tt0 -81.23 -51.92 0.86 Allowed Pre-proline 0 CA--C 1.533 0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.389 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.748 ' HB2' HG22 ' A' ' 38' ' ' VAL . 93.7 Cg_endo -78.62 137.95 14.86 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.171 1.914 . . . . 0.0 112.32 -179.905 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -90.69 39.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.748 HG22 ' HB2' ' A' ' 36' ' ' PRO . 1.9 m -98.55 67.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.071 -179.959 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.37 89.67 7.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.919 -179.947 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 37.7 mtm -83.72 1.3 43.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 179.918 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 55.38 63.98 1.92 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.99 -179.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -136.34 92.22 15.78 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 -179.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.25 -168.89 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.591 2.194 . . . . 0.0 112.275 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.12 156.58 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.068 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 46' ' ' HIS . 0.0 OUTLIER -97.82 -79.2 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.935 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.422 ' H ' HG23 ' A' ' 45' ' ' VAL . 36.8 m80 -110.26 94.17 4.87 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.975 0.417 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.459 ' O ' ' HG3' ' A' ' 50' ' ' GLN . 9.8 p -88.88 31.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.202 0.525 . . . . 0.0 110.944 -179.684 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -68.01 -18.14 64.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.0 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.77 67.24 0.58 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.871 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 47' ' ' VAL . 89.6 mt-30 -93.04 100.82 13.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.739 0.304 . . . . 0.0 110.88 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -85.89 108.37 16.59 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.913 -179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 6.3 Cg_exo -78.85 -177.07 3.63 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.872 2.381 . . . . 0.0 112.058 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.714 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -79.21 153.65 29.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.736 179.347 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.862 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.11 -176.44 2.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.294 179.099 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 104' ' ' MET . . . -52.23 -25.06 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 111.269 -179.488 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.451 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 40.6 m -74.23 -49.13 24.65 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.741 179.562 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.714 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.11 -39.45 78.69 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.376 0.608 . . . . 0.0 109.997 178.776 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.463 ' CD1' ' HA ' ' A' ' 55' ' ' ALA . 8.3 mt -64.1 -45.04 90.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.418 179.102 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.79 -7.85 18.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.844 179.066 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.445 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 23.4 t -84.05 -7.3 59.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.616 179.317 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.609 ' HB2' ' H ' ' A' ' 65' ' ' GLU . . . -133.18 55.47 16.96 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.319 179.819 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.584 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 62.7 Cg_endo -101.59 122.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.184 2.589 . . . . 0.0 112.986 -178.435 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.535 ' HD3' HG21 ' A' ' 15' ' ' THR . 88.8 Cg_endo -100.1 31.33 10.8 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 124.463 -1.057 . . . . 0.0 112.095 -0.606 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.416 ' HB3' ' HB2' ' A' ' 61' ' ' ALA . 4.0 tt0 -55.61 -89.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.586 -178.428 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -107.11 28.14 8.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.004 -179.29 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -44.0 69.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.051 0.453 . . . . 0.0 110.123 179.147 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.85 36.72 2.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.473 178.471 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.652 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.3 tp-100 -127.6 -52.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.636 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 14.4 mtm -76.03 -6.17 49.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.659 -179.378 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -63.2 -32.45 73.85 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.172 -179.421 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.778 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -148.74 27.48 1.31 Allowed Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.822 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 3.3 mt-10 -142.29 0.39 1.33 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.891 0.377 . . . . 0.0 111.173 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.551 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -136.12 -20.84 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.169 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.699 HD13 HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -73.48 -22.7 60.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.353 178.283 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.54 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -39.82 -56.04 3.34 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.355 -177.906 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.551 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 11.6 Cg_exo -73.1 -15.74 25.69 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.326 2.017 . . . . 0.0 112.784 -179.255 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.686 HD11 ' HB2' ' A' ' 53' ' ' LEU . 37.1 mt -91.23 -32.01 15.93 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.624 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.596 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.5 mm -65.19 -37.13 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.089 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.745 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.0 mt-30 -48.92 -16.16 0.12 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.495 177.14 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 78' ' ' ILE . . . -84.27 -44.58 13.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.675 178.186 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.617 ' HE3' ' HA ' ' A' ' 112' ' ' ARG . 1.2 mtm -67.67 -27.81 67.16 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.563 0.697 . . . . 0.0 110.18 178.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.7 ' HE2' HG12 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -114.29 164.2 16.97 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.739 -177.257 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.474 ' HD2' ' CG ' ' A' ' 82' ' ' HIS . 74.0 Cg_endo -77.11 47.68 2.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.134 1.889 . . . . 0.0 111.368 177.021 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.745 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 66.45 51.05 1.2 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.796 -178.487 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.44 ' HB3' ' CD2' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -118.94 0.81 11.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.719 179.789 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.554 ' CB ' ' HB ' ' A' ' 78' ' ' ILE . . . -73.46 58.63 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.179 179.455 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -98.24 -0.7 58.3 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.886 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.5 ttpt -156.74 -15.79 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.023 -0.588 . . . . 0.0 111.908 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.585 HG12 HD23 ' A' ' 122' ' ' LEU . 48.5 mt -51.18 -84.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -176.812 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.778 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -51.46 -38.37 53.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.02 -177.851 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.95 -29.87 68.77 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.99 -1.1 . . . . 0.0 110.367 176.262 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.886 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.4 ttm -75.56 -37.75 59.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.042 176.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.545 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 4.6 mm? -55.61 -8.34 0.37 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.48 -178.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.631 HD11 ' HA3' ' A' ' 71' ' ' GLY . 4.9 mp -106.26 27.94 8.2 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.688 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -171.98 3.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.462 -178.252 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.938 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.22 -151.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.318 0.58 . . . . 0.0 111.496 -179.86 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.8 t0 -59.53 -3.54 0.48 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.237 178.253 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.574 ' H ' HG12 ' A' ' 96' ' ' ILE . 27.4 m120 77.82 -27.23 0.17 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.425 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.415 ' H ' ' C ' ' A' ' 97' ' ' ASP . 1.3 m -77.75 -23.35 49.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 177.785 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.938 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.92 -25.87 29.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.676 177.512 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.52 HD13 HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -74.99 -24.75 58.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.393 0.615 . . . . 0.0 109.385 176.134 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -86.73 -48.6 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.074 -0.967 . . . . 0.0 111.158 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.415 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.04 -37.28 83.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.194 -178.695 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.747 ' HE1' HD21 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -57.56 -36.82 72.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.136 -179.85 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 6.9 mt -87.11 -9.77 54.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.211 0.529 . . . . 0.0 110.047 178.445 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.415 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 62.8 mm-40 -108.44 -1.98 19.4 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.28 -176.144 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.818 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -150.32 135.95 10.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.764 -179.462 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.417 ' O ' HG22 ' A' ' 54' ' ' THR . 72.5 Cg_endo -74.04 3.98 4.63 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.566 2.177 . . . . 0.0 112.04 179.025 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 113' ' ' SER . 7.7 mt-10 -128.0 -11.41 5.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.607 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.818 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.83 -44.68 22.48 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.606 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.862 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.28 -40.82 17.67 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.95 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.617 ' HA ' ' HE3' ' A' ' 81' ' ' MET . 2.4 ttt180 -81.16 -64.39 1.2 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.28 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.562 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.01 -51.13 25.24 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 -178.702 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.795 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 30.9 mmtt -61.01 -30.18 70.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.845 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.583 HG13 ' CG2' ' A' ' 89' ' ' ILE . 1.4 t -72.83 -55.0 14.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.981 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.617 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 0.5 OUTLIER -56.9 -28.65 62.2 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.227 0.537 . . . . 0.0 109.927 177.314 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -80.02 -33.93 38.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.383 177.223 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.449 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -68.67 -17.87 64.17 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.514 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.7 HG12 ' HE2' ' A' ' 82' ' ' HIS . 37.1 t -66.77 -52.79 41.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.412 175.864 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.06 -27.49 61.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.968 177.389 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 121' ' ' VAL . 15.2 t -85.94 -31.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.691 179.123 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.614 ' HA ' ' HZ3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.14 -29.35 61.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.348 -179.733 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -83.2 -23.59 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.786 177.28 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -86.94 -6.14 58.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.054 179.32 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -115.61 -36.13 4.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.82 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.82 -81.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 177.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.29 54.93 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 174.165 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 128.55 36.29 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.043 -175.113 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -87.18 -1.14 57.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.333 177.347 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.81 -7.28 49.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.72 -8.73 57.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.6 130.66 43.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.92 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 29.5 mmtt -69.18 -18.47 63.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.841 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.07 112.41 23.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.995 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 4.6 m -88.67 48.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -90.14 16.41 8.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.869 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.6 -65.69 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -86.44 -44.45 12.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.15 -179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.92 93.54 8.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.904 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -96.74 158.79 21.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.541 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.625 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 12.0 t -97.7 -51.49 0.22 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.772 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.625 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 47.4 Cg_exo -56.45 -52.41 7.13 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.15 1.9 . . . . 0.0 112.323 -179.866 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 67.7 p -105.61 126.04 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.014 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.008 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.679 HD12 ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.838 0.351 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.689 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -173.98 -163.76 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.514 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.666 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.29 -43.8 88.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.506 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 m -56.56 -45.39 81.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.844 0.354 . . . . 0.0 110.487 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.43 -40.43 94.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.666 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -60.98 -45.38 95.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -9.1 52.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.08 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.0 t -82.41 -8.73 59.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.169 179.72 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.053 0.454 . . . . 0.0 110.772 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.577 ' CA ' HD21 ' A' ' 70' ' ' LEU . 4.7 mmtt -124.79 35.17 4.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.577 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -130.42 -61.97 0.94 Allowed 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.5 ' HA ' ' HB2' ' A' ' 73' ' ' ARG . 35.9 mtm -58.82 -9.38 1.76 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.712 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -70.12 -28.31 65.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.961 0.41 . . . . 0.0 110.81 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.046 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -146.52 9.92 1.45 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.442 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.28 -9.62 6.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.538 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.16 -12.73 5.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.909 0.385 . . . . 0.0 110.531 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.679 ' HG ' HD12 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.59 -17.1 58.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.928 -179.313 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.704 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.7 t80 -47.12 -54.57 19.93 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 22.1 Cg_exo -65.37 -9.25 21.48 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.134 1.889 . . . . 0.0 112.249 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.3 mm? -96.3 -39.06 9.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.794 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.675 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.0 mm -60.34 -41.61 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.859 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.674 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.4 mt-30 -48.53 -20.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.627 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.72 -43.67 16.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.856 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.466 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -67.78 -40.85 83.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.5 179.604 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.846 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.9 m170 -123.18 144.1 42.65 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.55 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -55.75 81.57 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.478 2.119 . . . . 0.0 111.715 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.674 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 9.4 t 41.42 30.3 0.13 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.276 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.56 0.4 34.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.675 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.67 -138.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.621 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.88 -8.56 49.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.856 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.573 ' HE2' ' SD ' ' A' ' 92' ' ' MET . 1.2 tptt -161.3 -25.6 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.738 -0.231 . . . . 0.0 111.501 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.81 HG21 HG13 ' A' ' 115' ' ' VAL . 61.0 mt -49.2 -80.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.046 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.63 -38.51 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.684 -0.235 . . . . 0.0 110.937 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.79 -28.7 57.55 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.573 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.39 -34.34 54.9 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.199 0.523 . . . . 0.0 109.827 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.949 ' HB3' ' HE3' ' A' ' 104' ' ' MET . 4.5 mm? -58.76 -7.97 1.17 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.691 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.694 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.4 mp -107.84 27.83 8.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.404 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.9 pt-20 -171.59 3.24 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.521 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.964 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.332 0.587 . . . . 0.0 111.85 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.42 -2.46 0.32 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.361 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 9.6 m-20 78.27 -30.12 0.16 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.42 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.87 -31.88 65.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.074 0.464 . . . . 0.0 109.83 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.964 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.9 OUTLIER -76.37 -23.3 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.775 177.556 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.629 ' HB2' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -75.27 -23.75 57.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.049 177.172 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.524 HD12 HD23 ' A' ' 101' ' ' LEU . 3.7 mp -91.07 -45.67 8.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.3 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -39.6 92.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.056 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.949 ' HE3' ' HB3' ' A' ' 93' ' ' LEU . 0.1 OUTLIER -59.98 -33.13 71.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.491 -179.56 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.712 HD21 HD13 ' A' ' 70' ' ' LEU . 17.3 mt -85.37 -12.35 52.37 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.742 0.306 . . . . 0.0 110.946 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -8.62 17.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.783 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -142.89 132.54 11.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.87 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 13.8 Cg_exo -69.88 1.62 4.35 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.893 2.395 . . . . 0.0 111.913 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -120.37 -26.56 5.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.272 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.93 -45.24 90.13 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.689 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -57.19 -26.28 60.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.062 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -88.28 -46.58 9.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.256 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 t -69.3 -33.53 73.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.874 0.369 . . . . 0.0 110.713 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.681 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 6.8 mmtt -78.85 -27.81 44.2 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.185 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.81 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -72.39 -55.88 11.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.298 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.467 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 20.2 t0 -52.91 -39.01 62.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 177.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -39.66 75.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.423 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.81 -22.07 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.043 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.846 HG21 ' CE1' ' A' ' 82' ' ' HIS . 56.1 t -65.3 -44.77 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.938 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.14 -25.93 65.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.505 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.2 t -86.92 -31.39 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.857 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -71.98 -40.53 68.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.992 179.178 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.42 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 81.1 mm-40 -68.48 -32.01 71.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.159 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.923 179.065 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.71 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.752 0.31 . . . . 0.0 110.67 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.731 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.58 -167.44 0.78 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.433 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 1.03 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.57 -43.97 65.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.852 -178.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -57.72 -51.23 70.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.874 0.369 . . . . 0.0 110.747 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.514 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.19 -38.59 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.248 179.166 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.03 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.0 mt -63.96 -42.89 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.064 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.18 -15.59 60.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.058 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.6 m -73.86 -6.98 50.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.884 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.039 -179.966 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.918 0.39 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.576 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -129.75 28.65 5.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.841 179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.51 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.37 -54.98 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.965 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.52 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -75.52 18.1 0.25 Allowed 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -177.483 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.729 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.42 -32.58 17.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.239 0.542 . . . . 0.0 110.445 179.619 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.125 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.15 11.6 4.74 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.037 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.471 ' HG2' ' HG3' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -129.26 -8.54 4.75 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.145 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -127.34 -14.17 5.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.774 0.321 . . . . 0.0 110.969 179.852 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.631 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.31 -10.99 59.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.708 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 11.5 t80 -49.01 -55.41 20.78 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.68 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.6 Cg_exo -62.34 -9.73 16.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.087 1.858 . . . . 0.0 112.157 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.71 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.5 mm? -98.81 -28.21 13.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.579 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.75 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.8 mm -70.6 -40.47 77.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.732 0.301 . . . . 0.0 111.244 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.778 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.7 mt-30 -52.62 -19.3 2.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.351 0.596 . . . . 0.0 110.103 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.26 -38.88 30.04 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.959 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.75 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.2 -48.63 33.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.24 0.543 . . . . 0.0 110.167 179.413 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.848 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.5 m-70 -111.97 146.18 34.26 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.467 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.587 ' HD2' HD12 ' A' ' 85' ' ' LEU . 36.6 Cg_exo -57.18 78.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.544 2.163 . . . . 0.0 112.014 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.778 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 48.17 37.17 7.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.062 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.848 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.3 OUTLIER -92.48 4.99 52.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -179.351 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.635 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.88 -138.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.948 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.85 -10.14 53.38 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.793 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.647 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.1 tptt -159.96 -23.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.694 -0.253 . . . . 0.0 111.536 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.844 HG21 HG13 ' A' ' 115' ' ' VAL . 69.2 mt -49.68 -81.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.125 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -55.95 -37.72 69.39 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.636 0.255 . . . . 0.0 110.672 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.63 -28.45 59.93 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.218 -0.991 . . . . 0.0 110.648 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.8 ttp -76.91 -33.99 57.74 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.352 0.596 . . . . 0.0 109.718 177.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.71 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -60.23 -4.61 0.85 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.829 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.651 HD13 ' HA3' ' A' ' 71' ' ' GLY . 3.4 mp -110.04 25.88 11.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 176.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -168.04 1.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.358 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.92 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.21 -153.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.439 0.638 . . . . 0.0 111.955 -179.531 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -59.82 -2.62 0.41 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.302 178.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.591 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.49 -36.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.163 -179.466 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 3.0 m -65.28 -27.35 68.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.847 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.92 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -82.99 -25.62 32.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.587 177.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.678 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 2.3 tp -75.14 -25.33 58.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.701 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.75 -48.02 7.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.323 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.461 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.3 OUTLIER -65.27 -37.01 85.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.429 -178.216 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.71 ' HE1' ' HB3' ' A' ' 93' ' ' LEU . 8.2 ptm -60.09 -38.17 82.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.797 0.332 . . . . 0.0 111.083 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.825 HD23 HD13 ' A' ' 58' ' ' LEU . 40.2 mt -81.64 -11.43 59.1 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.953 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.48 -9.11 14.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.857 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.836 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -140.77 126.95 11.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.661 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 17.1 Cg_exo -68.07 6.72 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.876 2.384 . . . . 0.0 112.314 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 107' ' ' SER . 2.1 tt0 -127.8 -26.43 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.1 -46.78 85.72 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.268 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -49.99 -23.71 2.18 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.779 178.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 112' ' ' ARG . 15.1 mtp180 -92.96 -62.96 1.28 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.2 t -50.05 -29.54 9.03 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.126 0.489 . . . . 0.0 109.791 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.667 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -81.0 -42.98 20.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.666 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.844 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -63.97 -58.15 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -50.98 -42.72 60.36 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.734 0.302 . . . . 0.0 110.868 178.32 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 113' ' ' SER . 4.4 mt-10 -70.31 -32.46 70.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.327 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.01 -24.74 64.25 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.113 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.721 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -63.38 -46.11 96.27 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 CA-C-O 121.291 0.567 . . . . 0.0 109.664 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.44 -26.27 63.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.742 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 7.9 t -86.98 -32.63 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.741 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.61 -38.29 77.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.93 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.452 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 14.6 mm100 -74.16 -27.0 60.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.962 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.268 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.073 178.876 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.764 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.613 0.244 . . . . 0.0 110.535 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.889 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -170.21 -159.37 0.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.751 179.501 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -60.69 -37.31 81.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.313 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.3 m -59.8 -46.46 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.349 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.92 -40.65 94.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.191 178.531 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.626 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.31 -47.19 84.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.561 179.214 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.94 -12.68 61.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.217 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' A' ' 57' ' ' MET . 46.3 t -76.39 -7.36 54.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.185 179.936 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 120.739 0.304 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.54 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.8 mtpt -124.83 18.16 8.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.358 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.75 -43.57 3.13 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.396 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.406 ' HA ' ' HB2' ' A' ' 73' ' ' ARG . 30.4 mtm -77.22 -9.63 58.91 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -39.61 80.49 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.332 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.061 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -144.65 28.71 1.89 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.817 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -138.47 -9.32 1.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.583 0.23 . . . . 0.0 111.308 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.06 -14.84 5.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.783 0.325 . . . . 0.0 111.007 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.719 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.01 -25.19 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.855 -179.614 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.483 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.0 t80 -42.75 -55.69 6.94 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.169 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 19.3 Cg_endo -59.7 -18.23 46.97 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.976 1.784 . . . . 0.0 112.386 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 53' ' ' LEU . 84.8 mt -99.09 -22.15 15.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.991 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.626 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.9 mm -65.46 -37.87 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.895 0.379 . . . . 0.0 110.431 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.4 mt-30 -53.93 -18.11 3.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.78 -34.57 30.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.08 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.483 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -79.35 -40.78 29.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.067 -178.326 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.735 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.4 m-70 -118.12 159.68 42.17 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.234 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.69 ' HG2' HD23 ' A' ' 85' ' ' LEU . 37.8 Cg_endo -64.71 75.17 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.31 2.007 . . . . 0.0 111.796 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 43.8 p 45.73 36.09 2.54 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.982 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.69 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -87.23 1.84 51.92 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.045 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.658 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -65.72 -143.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.095 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.31 -11.66 60.39 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.301 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.888 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.1 ttpt -160.47 -21.96 0.06 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.812 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -49.03 -80.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.061 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.6 -39.22 67.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.575 0.226 . . . . 0.0 110.768 -179.37 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.66 -27.54 64.04 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.888 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.8 ttm -76.46 -36.42 57.92 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.516 0.674 . . . . 0.0 109.561 177.041 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.661 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -57.71 -6.83 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.432 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.14 27.39 9.33 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.43 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.6 pt-20 -170.84 2.57 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.091 -0.958 . . . . 0.0 111.357 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.34 -150.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.456 0.646 . . . . 0.0 111.77 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.563 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 8.1 t0 -59.09 -3.97 0.44 Allowed 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.043 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.585 ' H ' HG12 ' A' ' 96' ' ' ILE . 8.5 m120 78.79 -26.48 0.17 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.483 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.39 -32.12 60.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.103 0.477 . . . . 0.0 109.865 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.2 mt-10 -74.79 -24.85 58.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.837 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.642 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.7 tp -75.02 -24.66 58.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.958 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.9 mp -90.47 -47.03 7.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.122 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -37.12 85.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.352 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.681 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 6.0 ptm -60.07 -39.07 84.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.742 0.306 . . . . 0.0 110.793 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.588 HD21 ' HB3' ' A' ' 70' ' ' LEU . 59.8 mt -78.33 -13.13 59.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.541 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -109.41 -5.13 15.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.037 -177.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.837 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.7 t -147.31 139.69 14.21 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.228 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.659 ' O ' HG21 ' A' ' 54' ' ' THR . 85.8 Cg_endo -80.05 2.92 8.05 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.981 2.454 . . . . 0.0 112.009 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -122.87 -18.96 6.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.306 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.837 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -72.24 -50.62 25.96 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.844 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.889 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.1 tt -50.09 -34.19 21.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.112 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -85.69 -60.04 2.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.228 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.5 m -53.63 -35.86 61.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.866 0.365 . . . . 0.0 111.027 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.647 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.2 mmtt -78.73 -28.59 44.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.557 179.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.812 HG13 HG21 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -71.07 -50.63 40.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.388 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.415 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.3 -38.82 81.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.432 177.974 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.1 -33.32 67.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.595 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.807 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -65.43 -30.11 70.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.656 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.735 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -56.61 -53.38 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.699 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.33 -25.68 16.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.348 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.81 -32.55 6.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.422 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.831 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.28 -39.36 74.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.086 179.077 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.492 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -73.13 -26.91 61.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.659 178.049 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.504 179.491 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.782 ' HB2' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.727 0.299 . . . . 0.0 110.823 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.864 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.14 -176.18 1.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.042 178.59 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.997 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.48 -43.7 45.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.839 -179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -60.36 -48.14 83.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.026 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.613 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.22 -42.06 85.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.294 0.569 . . . . 0.0 110.472 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.997 HD12 ' HA ' ' A' ' 55' ' ' ALA . 9.5 mt -62.38 -45.17 94.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.19 -15.22 44.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.966 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 t -76.08 -6.32 50.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.104 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.934 0.397 . . . . 0.0 110.609 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.645 ' HA ' HD11 ' A' ' 70' ' ' LEU . 9.4 pttt -131.43 26.89 4.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.895 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.458 ' N ' HD21 ' A' ' 70' ' ' LEU . 3.9 mt-30 -131.02 -56.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.426 ' HB2' ' CB ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -77.98 18.35 0.5 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.645 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.1 -32.76 17.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.31 0.576 . . . . 0.0 110.138 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.072 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -131.33 12.6 5.48 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.739 178.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -128.66 -3.42 5.34 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.99 -19.79 4.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.83 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.683 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.29 -22.17 52.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.107 -178.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.648 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.8 t80 -44.55 -55.17 10.78 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.102 -177.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 31.5 Cg_exo -60.4 -15.71 37.28 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.166 1.911 . . . . 0.0 112.711 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.782 HD23 ' HB2' ' A' ' 53' ' ' LEU . 0.1 OUTLIER -98.65 -28.41 13.55 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.341 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.8 mm -61.66 -40.52 86.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.577 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.863 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 19.0 mt-30 -52.31 -17.43 1.15 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.914 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.22 -35.65 23.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.079 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.9 -37.62 58.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.925 -179.345 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.763 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.8 m-70 -121.22 162.64 34.62 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.502 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -67.46 71.67 0.64 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.298 1.998 . . . . 0.0 111.86 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.863 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.4 p 49.11 32.35 4.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.119 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 27.4 mt -84.71 5.91 26.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.22 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.53 -141.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.898 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.31 -10.67 34.49 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.456 -0.878 . . . . 0.0 111.608 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.857 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.1 OUTLIER -156.3 -25.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 179.791 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.849 HG21 HG13 ' A' ' 115' ' ' VAL . 56.6 mt -49.26 -85.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-O 120.629 0.252 . . . . 0.0 111.558 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.072 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.98 -40.0 66.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.0 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.59 -30.02 58.55 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.168 -1.015 . . . . 0.0 111.029 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.857 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.77 -25.62 32.61 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.77 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.3 mm? -60.77 -8.08 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.677 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.561 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.9 mm? -105.79 25.84 10.35 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.568 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 3.9 pt-20 -167.3 1.58 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.547 -178.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.899 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.0 -152.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.448 0.642 . . . . 0.0 111.963 -179.137 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.5 t70 -59.08 -2.95 0.3 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.272 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.7 m-80 78.14 -28.78 0.16 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.28 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.59 -31.03 64.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.132 0.491 . . . . 0.0 109.839 177.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.899 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.8 OUTLIER -78.17 -22.29 48.9 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.633 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.4 tp -75.14 -24.74 58.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.782 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.403 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.6 mp -91.15 -47.3 7.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.221 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -37.18 86.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.59 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.804 ' HB2' HD22 ' A' ' 111' ' ' LEU . 8.3 ptm -59.53 -38.74 81.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.572 0.225 . . . . 0.0 111.033 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 58' ' ' LEU . 4.0 mt -86.62 -7.71 58.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.11 0.481 . . . . 0.0 110.093 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 68.7 mm-40 -108.99 -5.8 15.92 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.771 -177.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.721 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.3 t -146.05 130.95 8.98 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 111.447 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.472 ' O ' HG21 ' A' ' 54' ' ' THR . 57.0 Cg_endo -70.68 8.6 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.552 2.168 . . . . 0.0 112.076 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.67 -27.51 2.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.308 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.721 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -63.95 -44.57 92.4 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.054 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.15 -42.23 13.63 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 175.832 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.437 ' HG2' ' N ' ' A' ' 113' ' ' SER . 2.3 ttt180 -79.68 -64.91 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.522 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.437 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 33.3 t -48.65 -52.63 22.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.788 0.328 . . . . 0.0 111.328 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 10.5 mmtm -60.21 -30.96 69.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.05 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.849 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.19 -53.76 20.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -36.91 62.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.031 0.443 . . . . 0.0 110.491 177.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.81 -33.96 60.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.985 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.12 -24.37 65.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.043 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.763 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -65.49 -49.2 79.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.68 176.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.83 -27.49 60.2 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.6 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 6.5 t -84.43 -30.28 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.691 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.16 -37.99 61.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.157 179.122 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -75.28 -20.25 59.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.028 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.636 -179.744 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.848 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.935 0.398 . . . . 0.0 111.269 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.797 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.46 -158.82 0.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.279 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.752 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -60.62 -40.64 92.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.447 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.3 m -58.27 -46.15 86.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.398 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.848 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.45 -43.33 93.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.12 178.558 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.752 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.93 -48.74 75.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.487 178.992 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.29 -9.69 49.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.665 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.7 m -84.73 -8.38 58.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.217 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.553 -179.814 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.627 ' C ' HD21 ' A' ' 70' ' ' LEU . 35.9 mtmt -131.94 29.21 4.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.216 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 4.0 mt-30 -127.37 -48.1 1.44 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.56 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -81.03 13.76 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.179 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.798 HD22 ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -81.55 -40.35 23.24 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 120.906 0.384 . . . . 0.0 110.121 179.328 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.052 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.8 36.13 2.41 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.84 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 1.4 pt-20 -150.85 -11.85 0.23 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.434 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.92 -15.29 5.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 110.687 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.708 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.92 -12.43 59.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.31 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.476 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 9.1 t80 -48.19 -54.91 21.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.818 -177.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.7 Cg_endo -65.03 -8.08 17.2 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.114 1.876 . . . . 0.0 112.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.589 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.6 mm? -98.54 -28.19 13.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.267 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.779 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.7 mm -69.13 -40.38 80.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.322 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.937 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.9 mt-30 -51.19 -18.3 0.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.281 0.562 . . . . 0.0 110.355 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.35 -39.98 22.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.211 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.779 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.74 -44.35 61.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.091 0.472 . . . . 0.0 110.742 -179.596 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.738 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.7 m-70 -115.51 155.76 46.84 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.642 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -62.92 76.18 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.508 2.139 . . . . 0.0 111.736 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.937 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.5 p 46.84 33.7 2.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.133 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.701 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 17.9 mt -87.18 6.41 33.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.211 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.672 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.6 -137.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.961 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.1 -15.86 25.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.769 -178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.886 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.0 ttpt -156.62 -21.6 0.1 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.845 HG21 HG13 ' A' ' 115' ' ' VAL . 62.0 mt -49.54 -81.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.052 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.26 -39.3 66.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.455 0.169 . . . . 0.0 110.795 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.07 -28.03 63.3 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.093 -1.051 . . . . 0.0 110.573 176.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.886 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.7 ttm -76.32 -36.87 58.07 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.521 0.677 . . . . 0.0 109.793 177.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -56.98 -6.32 0.34 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.561 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 70' ' ' LEU . 2.3 mm? -108.75 27.7 9.17 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.419 ' H ' ' H ' ' A' ' 96' ' ' ILE . 6.5 pt-20 -170.1 1.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.195 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.958 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.16 -153.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 121.4 0.619 . . . . 0.0 111.616 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 96' ' ' ILE . 7.6 t0 -59.34 -3.14 0.37 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.139 178.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.58 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.9 -35.14 0.17 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.264 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -67.32 -25.77 66.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.833 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.958 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.56 -24.67 31.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.858 177.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -74.95 -27.19 60.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.54 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.7 mp -86.69 -46.83 9.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.36 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -37.93 85.06 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.201 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.771 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.86 -36.09 74.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.157 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 16.3 mt -86.92 -9.92 54.53 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.136 0.493 . . . . 0.0 110.1 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -107.5 -6.44 17.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.258 -176.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.856 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -148.71 130.33 7.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.636 0.255 . . . . 0.0 111.518 -179.387 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.482 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.57 -0.53 6.08 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.926 2.417 . . . . 0.0 112.465 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -123.69 -13.66 7.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.535 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.856 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -71.94 -46.04 58.96 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.016 0.436 . . . . 0.0 110.202 178.298 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.797 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.4 tt -56.17 -29.23 60.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.12 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -88.2 -51.64 5.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.266 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 m -64.02 -35.1 79.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.958 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 27.0 mmtt -78.98 -29.5 43.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.58 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.81 -51.44 40.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.158 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.65 -37.76 73.9 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.378 178.695 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -37.58 70.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.696 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.87 -26.97 69.03 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.962 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.738 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.5 t -62.13 -47.69 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.305 0.574 . . . . 0.0 109.807 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.73 -24.27 61.25 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.857 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.9 t -87.15 -35.42 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.421 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.78 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -66.31 -38.68 88.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.595 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 4.6 mm-40 -71.99 -29.11 63.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.406 176.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.232 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.558 179.043 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.749 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.659 0.266 . . . . 0.0 110.893 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.791 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.79 -161.86 0.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.666 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -59.59 -36.92 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.382 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 2.0 m -60.73 -45.7 93.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.405 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.81 -40.96 94.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.262 0.553 . . . . 0.0 110.113 178.371 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.629 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.04 -47.88 81.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.721 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -8.88 50.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 t -81.75 -9.51 59.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.007 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.163 179.791 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.105 0 CA-C-O 120.932 0.396 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.569 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -128.49 34.85 4.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.49 ' N ' HD21 ' A' ' 70' ' ' LEU . 38.2 tt0 -133.29 -53.86 0.9 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.876 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.511 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.2 ptt? -80.63 22.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.599 ' N ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.16 -40.9 12.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.118 0.485 . . . . 0.0 110.196 179.384 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.974 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -125.64 13.79 7.27 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -130.1 -2.4 4.56 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.511 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 20.4 tpp180 -127.11 -22.9 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.081 0.467 . . . . 0.0 111.107 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.99 -17.82 60.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.008 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 11.2 t80 -46.02 -54.88 14.95 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 27.6 Cg_endo -62.17 -15.27 43.15 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.121 1.88 . . . . 0.0 112.506 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.749 HD12 ' HB2' ' A' ' 53' ' ' LEU . 54.2 mt -98.74 -23.38 15.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.898 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.2 mm -66.37 -41.28 88.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.371 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.6 mt-30 -53.25 -18.37 2.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.58 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.56 -36.09 29.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.84 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.421 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.84 -51.29 14.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.68 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.749 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.2 m-70 -105.16 160.85 24.6 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.237 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.407 ' HD2' HD12 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.4 71.72 0.62 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.287 1.991 . . . . 0.0 111.949 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 50.84 38.98 21.25 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.857 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.563 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 25.2 mt -95.42 9.87 38.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.313 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.35 -141.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.733 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.45 -25.03 7.53 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.654 -178.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -156.38 12.28 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.46 0.171 . . . . 0.0 111.362 178.839 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.784 HG21 HG13 ' A' ' 115' ' ' VAL . 88.0 mt -76.19 -89.23 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 119.811 -0.755 . . . . 0.0 110.202 178.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.974 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.38 -40.64 59.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.075 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.66 -32.4 54.04 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.31 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.763 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -83.92 -23.12 31.32 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.815 0.341 . . . . 0.0 110.199 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.603 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.39 -6.66 2.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.389 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.589 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.7 mm? -105.14 24.25 12.33 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 176.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.3 pt-20 -166.86 1.73 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.704 -178.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.903 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.98 -151.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.376 0.608 . . . . 0.0 111.826 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.9 t0 -59.23 -3.44 0.4 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.143 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.596 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.3 m-20 78.08 -28.61 0.16 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.509 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.2 m -74.72 -25.15 58.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.903 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.5 OUTLIER -82.64 -26.15 32.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.596 177.251 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 94' ' ' LEU . 2.7 tp -75.06 -25.91 59.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.467 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.1 -47.64 9.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.065 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.417 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.74 -37.87 82.76 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.3 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.705 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.22 -35.97 72.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.268 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.588 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.5 mt -87.05 -12.85 46.08 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.259 0.552 . . . . 0.0 110.068 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 57.6 mm-40 -102.49 -8.01 21.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.19 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.834 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -147.32 134.5 10.22 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.677 0.275 . . . . 0.0 111.722 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 59.4 Cg_endo -72.18 2.19 5.22 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.69 2.26 . . . . 0.0 112.24 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 113' ' ' SER . 5.7 mt-10 -126.71 -13.7 5.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.576 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.834 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -73.11 -45.13 58.79 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.045 0.45 . . . . 0.0 110.051 177.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.791 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.0 tt -56.88 -30.74 64.17 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.119 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -89.76 -44.75 9.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.301 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -68.03 -35.66 78.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.699 -179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.573 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 23.7 mmtt -78.79 -29.42 44.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.49 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.784 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.56 -52.19 31.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.473 ' CG ' ' HE2' ' A' ' 82' ' ' HIS . 7.0 t70 -59.0 -34.88 72.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.394 177.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -29.26 48.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.868 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.763 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.99 -25.31 63.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.781 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.749 HG11 ' ND1' ' A' ' 82' ' ' HIS . 13.1 t -64.96 -51.49 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.877 177.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.35 -24.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.531 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.69 -31.96 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.82 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.68 -37.1 62.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -77.62 -22.72 50.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.098 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.318 179.635 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.654 HD22 HD22 ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.97 0.414 . . . . 0.0 110.907 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.687 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.12 -169.57 1.5 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.969 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.979 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -56.84 -31.96 65.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -50.64 61.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.676 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -57.75 -36.38 72.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.915 178.716 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.979 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.0 mt -68.22 -41.57 81.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.417 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.71 -12.69 17.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.913 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 m -75.29 -13.56 60.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.62 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.546 ' O ' ' HB2' ' A' ' 66' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.107 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.434 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.7 pttm -90.16 29.74 1.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.448 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.494 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -124.71 -46.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.967 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.677 ' HB2' HD23 ' A' ' 58' ' ' LEU . 43.7 mtm -74.49 -8.98 58.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.696 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.786 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -57.94 -52.53 65.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.66 0.267 . . . . 0.0 111.343 -177.807 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -123.6 23.54 6.68 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.329 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.494 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 2.2 mt-10 -136.73 2.31 2.64 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.466 0.174 . . . . 0.0 111.461 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.645 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -125.67 -34.52 2.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.656 ' HB3' HD11 ' A' ' 78' ' ' ILE . 2.3 mm? -59.5 -38.48 81.01 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.777 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -26.88 -61.54 0.18 Allowed Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -175.55 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.777 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 15.9 Cg_exo -69.18 -30.38 25.05 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.078 1.852 . . . . 0.0 112.273 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.9 mt -82.12 -17.6 45.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.972 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.656 HD11 ' HB3' ' A' ' 74' ' ' LEU . 11.4 mm -73.18 -43.18 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.88 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.4 mt-30 -50.88 -19.54 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.892 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.67 -40.18 29.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.886 178.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.487 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.79 -50.86 31.2 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.494 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.743 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.2 m-70 -109.08 153.76 42.38 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.572 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.458 ' HG2' HD13 ' A' ' 85' ' ' LEU . 26.1 Cg_endo -61.74 81.0 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.339 2.026 . . . . 0.0 111.789 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.88 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 42.0 33.47 0.37 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.641 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.537 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.8 mp -87.63 8.92 23.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.878 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.457 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -75.72 40.42 0.19 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.75 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.18 -12.64 81.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.758 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.783 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.1 ttpt -178.0 34.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.868 0.366 . . . . 0.0 110.668 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.811 HG21 HG13 ' A' ' 115' ' ' VAL . 61.7 mt -80.09 -91.88 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.85 -40.59 56.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.997 179.694 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.54 53.91 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.144 -1.026 . . . . 0.0 110.916 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.783 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.39 -25.48 33.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.508 -0.346 . . . . 0.0 110.133 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.623 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.5 mm? -59.83 -7.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.786 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -104.98 27.17 8.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -168.89 2.18 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.596 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.943 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.385 0.612 . . . . 0.0 111.712 -179.723 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.542 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.4 t0 -59.43 -3.05 0.38 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.087 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 78.63 -29.94 0.15 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.493 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -73.61 -27.87 61.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.045 0.45 . . . . 0.0 109.956 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.943 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -79.77 -23.48 42.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.097 177.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.16 -25.23 58.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.833 176.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.736 HD12 HD23 ' A' ' 101' ' ' LEU . 2.6 mp -88.4 -45.56 9.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.085 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.422 ' CD2' ' HE2' ' A' ' 114' ' ' LYS . 1.2 t60 -61.94 -45.95 91.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.759 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.692 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -54.09 -32.74 55.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.409 -179.574 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.813 HD23 HD13 ' A' ' 58' ' ' LEU . 66.5 mt -85.13 -11.68 54.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.801 0.334 . . . . 0.0 111.154 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -110.18 -6.12 15.16 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.549 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -146.8 140.18 14.86 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.678 -0.409 . . . . 0.0 112.064 -178.683 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.57 ' O ' HG21 ' A' ' 54' ' ' THR . 77.0 Cg_endo -77.01 3.69 6.41 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.668 2.246 . . . . 0.0 112.056 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -122.01 -22.61 5.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.536 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.549 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.2 p -64.35 -56.94 11.03 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 109.959 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.9 tt -51.64 -28.3 13.99 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.734 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.426 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.9 ttt85 -89.86 -60.82 1.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.08 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.426 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 50.3 m -55.65 -34.99 65.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.075 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.563 ' HD3' ' HB3' ' A' ' 100' ' ' GLU . 9.1 mttm -79.2 -32.99 44.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.714 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.811 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -66.54 -53.61 33.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 177.838 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.89 -35.72 69.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.375 178.166 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.09 -30.16 60.84 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.948 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.98 -19.64 61.85 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.615 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.743 HG11 ' ND1' ' A' ' 82' ' ' HIS . 18.1 t -68.49 -49.16 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.674 176.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.2 -27.38 63.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.603 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.32 -31.92 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.477 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.69 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.99 -41.92 73.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.826 178.697 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.509 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mm100 -68.82 -27.92 66.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.413 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.891 179.065 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.662 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.735 0.302 . . . . 0.0 110.844 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.573 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -173.51 -174.27 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.278 178.42 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 1.044 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.66 -42.13 44.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.793 -178.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.8 m -59.24 -52.3 66.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 110.679 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.449 ' O ' ' HE1' ' A' ' 69' ' ' MET . 0.0 OUTLIER -57.8 -40.24 79.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.044 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.9 mt -61.65 -44.33 97.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.048 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -16.53 51.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.976 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.2 t -73.93 -7.03 50.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.194 179.886 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.917 0.389 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.636 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.32 24.16 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.111 179.746 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.443 ' N ' HD21 ' A' ' 70' ' ' LEU . 16.2 tt0 -131.72 -52.82 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.544 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -77.62 15.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.296 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.815 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -88.86 -28.86 20.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.266 0.555 . . . . 0.0 110.139 179.267 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.053 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.77 11.61 5.15 Favored Glycine 0 N--CA 1.441 -0.988 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.597 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -130.74 -0.69 4.29 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.544 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.17 -21.3 3.95 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.9 0.381 . . . . 0.0 110.702 179.385 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.662 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.09 -15.14 60.16 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.032 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.706 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 3.0 t80 -40.06 -54.6 4.36 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.272 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 12.6 Cg_exo -70.33 -22.59 29.27 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.175 1.916 . . . . 0.0 112.125 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.0 OUTLIER -79.61 -31.5 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.717 -178.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.772 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 7.0 mm -68.69 -42.44 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.855 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.934 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.1 mt-30 -50.78 -18.26 0.7 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.323 0.582 . . . . 0.0 110.366 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.0 -41.58 20.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.835 178.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.772 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.5 OUTLIER -69.19 -43.71 73.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.464 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.784 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 3.4 m-70 -118.78 149.38 46.38 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.302 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.798 ' HG2' HD13 ' A' ' 85' ' ' LEU . 20.8 Cg_endo -59.67 77.68 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.299 2.0 . . . . 0.0 111.594 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.934 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 16.3 p 47.02 35.54 3.45 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.87 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 83' ' ' PRO . 0.8 OUTLIER -89.04 2.89 53.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.235 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -61.26 -114.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.756 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.597 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 63.39 -1.37 2.19 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.121 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.741 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -175.98 -20.62 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.816 HG21 HG13 ' A' ' 115' ' ' VAL . 69.8 mt -50.17 -84.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -177.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.053 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -53.53 -38.17 63.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.533 0.206 . . . . 0.0 110.949 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.11 -29.81 60.03 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.59 176.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.581 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.3 ttp -76.34 -35.09 58.92 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.072 -0.564 . . . . 0.0 110.021 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.65 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.28 -11.02 1.02 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.77 -177.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.621 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.68 28.25 7.66 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.414 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.0 pt-20 -172.86 2.5 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.827 -178.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.969 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.69 -149.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.433 0.635 . . . . 0.0 111.629 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.598 ' N ' HG12 ' A' ' 96' ' ' ILE . 13.0 t0 -53.16 -10.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.852 176.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.709 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.3 OUTLIER 80.6 -25.08 0.18 Allowed 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.824 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -73.48 -31.02 63.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.969 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -73.18 -33.52 65.47 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.82 177.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.52 ' N ' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -65.72 -24.12 66.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.296 178.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.9 mp -89.51 -48.25 7.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.26 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -37.32 81.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.286 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.672 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -59.72 -35.39 74.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.168 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.815 HD21 HD13 ' A' ' 70' ' ' LEU . 15.3 mt -86.78 -11.3 51.4 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.091 0.472 . . . . 0.0 110.066 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -105.63 -7.89 18.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.37 -175.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.863 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -146.58 131.72 9.05 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.673 0.273 . . . . 0.0 111.595 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 56.4 Cg_endo -70.66 2.54 3.93 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.635 2.223 . . . . 0.0 112.257 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -125.37 -16.66 5.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.699 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.863 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.3 OUTLIER -70.64 -46.55 63.07 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.006 0.431 . . . . 0.0 110.326 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.672 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 6.2 tt -54.28 -27.53 35.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.971 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.89 -51.93 5.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.362 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.1 t -64.23 -33.91 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.797 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.551 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 12.7 mmtp -78.93 -30.21 44.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.482 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.816 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.78 -50.42 49.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.646 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -57.32 -39.23 75.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.411 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -73.04 -29.47 63.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.869 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.54 -23.16 61.72 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.851 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.703 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.8 t -65.0 -48.65 83.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.588 0 CA-C-O 121.297 0.57 . . . . 0.0 109.687 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.15 -26.73 63.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.546 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.4 t -84.61 -30.69 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.792 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.741 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.91 -39.57 61.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.797 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.438 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.5 mm100 -65.52 -31.03 71.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.152 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.373 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.177 179.183 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.707 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.762 0.315 . . . . 0.0 110.833 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.784 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -171.29 -169.25 0.71 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.91 179.143 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 1.022 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.59 -30.85 61.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.631 0.253 . . . . 0.0 111.297 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.2 m -67.23 -49.89 62.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.608 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.28 -39.92 84.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.212 0.529 . . . . 0.0 110.212 178.759 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.022 HD12 ' HA ' ' A' ' 55' ' ' ALA . 12.5 mt -62.7 -45.5 92.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.634 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -15.03 58.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.912 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.3 t -75.29 -10.34 59.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.696 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.52 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.514 179.955 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.984 0.421 . . . . 0.0 110.549 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.585 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -115.92 29.87 7.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.586 179.376 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -137.57 -57.44 0.69 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.544 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.4 OUTLIER -74.45 -8.44 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.902 -178.683 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -40.73 83.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.679 0.276 . . . . 0.0 111.34 -179.635 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.967 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.72 27.94 3.02 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.451 -0.88 . . . . 0.0 112.579 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -141.2 -0.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.08 -22.62 2.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.642 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.698 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -72.9 -21.29 60.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.319 178.467 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.544 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -38.29 -57.15 1.89 Allowed Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.533 -178.12 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 55.5 Cg_endo -69.76 -20.31 35.0 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.982 1.788 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.645 HD12 ' HB2' ' A' ' 53' ' ' LEU . 65.7 mt -88.75 -19.49 25.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.631 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.698 HG12 ' O ' ' A' ' 74' ' ' LEU . 13.3 mm -73.85 -38.21 49.89 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.659 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.3 mt-30 -53.84 -16.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.923 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.85 -38.47 28.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.973 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.692 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.22 -46.07 57.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.103 0.477 . . . . 0.0 110.715 -179.689 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -111.88 159.15 34.54 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.762 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.768 ' HG2' HD23 ' A' ' 85' ' ' LEU . 36.4 Cg_endo -64.49 75.86 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.264 1.976 . . . . 0.0 111.871 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.659 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.6 OUTLIER 46.52 38.91 6.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.005 -178.901 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.9 OUTLIER -93.83 4.27 54.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.015 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.48 62.91 1.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.178 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -96.6 -8.05 57.52 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.5 tptt -177.48 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.891 -0.655 . . . . 0.0 110.158 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.824 HG21 HG13 ' A' ' 115' ' ' VAL . 68.1 mt -79.94 -88.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.359 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.967 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -52.7 -39.98 62.51 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.522 0.201 . . . . 0.0 111.014 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.17 -29.56 52.65 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.582 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.729 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.7 ttp -76.75 -33.66 58.1 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.107 -0.547 . . . . 0.0 109.988 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.47 -5.22 0.75 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.702 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.715 HD21 HD13 ' A' ' 70' ' ' LEU . 2.1 mm? -110.3 27.33 9.73 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -170.57 3.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.018 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.913 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -150.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.338 0.59 . . . . 0.0 111.512 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.567 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.4 t70 -59.52 -3.01 0.39 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.192 177.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.575 ' H ' HG12 ' A' ' 96' ' ' ILE . 15.4 m120 78.66 -29.72 0.15 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.48 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -32.94 65.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.44 . . . . 0.0 109.938 178.136 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.913 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -74.16 -23.83 59.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.876 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.435 ' CB ' HD11 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -75.18 -24.7 57.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.892 177.168 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.2 mp -90.2 -45.02 9.37 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.324 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -37.13 82.35 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.936 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.612 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -59.61 -35.87 75.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.285 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 58' ' ' LEU . 15.5 mt -87.1 -9.07 56.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.07 0.462 . . . . 0.0 110.058 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -108.93 -5.05 16.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.399 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.855 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.7 OUTLIER -148.54 129.52 7.04 Favored Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.673 -179.411 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.18 0.48 3.24 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.849 2.366 . . . . 0.0 112.555 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -126.31 -19.93 4.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.784 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.855 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -64.03 -47.94 78.27 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.325 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.784 ' HB3' HG22 ' A' ' 54' ' ' THR . 3.8 tt -50.39 -22.86 2.04 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.769 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -94.16 -62.87 1.26 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.196 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.0 t -50.23 -29.42 9.43 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.58 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 14.2 mmtp -81.18 -43.1 19.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.666 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.824 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -64.58 -58.2 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.265 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.431 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -51.02 -41.11 59.6 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.886 0.374 . . . . 0.0 110.83 178.425 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 113' ' ' SER . 12.5 mt-10 -71.68 -32.83 68.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.219 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.74 -23.05 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.037 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.2 t -65.28 -47.97 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 109.676 176.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.55 -27.68 64.79 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.482 177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.3 t -83.54 -32.42 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.693 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.83 -41.06 65.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.173 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.484 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.3 mm100 -61.74 -36.63 81.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.017 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.595 177.837 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.717 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 121.007 0.432 . . . . 0.0 110.998 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.881 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.08 -175.56 4.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.186 179.019 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 1.001 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.94 -32.68 47.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.342 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.3 m -67.19 -49.05 66.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.602 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.643 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -59.22 -37.04 76.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.318 0.58 . . . . 0.0 110.154 178.754 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.001 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.3 mt -64.51 -44.31 91.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.563 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.25 -10.4 41.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.577 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -75.37 -2.92 30.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.831 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 121.3 0.571 . . . . 0.0 110.658 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.641 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.94 19.52 4.82 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.319 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -116.91 -38.44 3.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.355 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.5 mtm -80.76 -7.73 59.47 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.894 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -60.71 -35.64 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -178.558 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -143.01 28.26 2.13 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.096 -1.05 . . . . 0.0 112.988 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -139.27 -6.53 1.38 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.778 0.323 . . . . 0.0 111.16 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.527 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.0 tmt_? -127.68 -19.48 4.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.132 0.491 . . . . 0.0 109.898 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.59 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -77.78 -26.35 49.69 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.76 178.898 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.536 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -38.75 -52.71 3.57 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.316 -177.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 14.2 Cg_exo -71.17 -22.78 25.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.289 1.993 . . . . 0.0 112.819 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.717 HD12 ' HB2' ' A' ' 53' ' ' LEU . 58.4 mt -88.02 -23.17 23.87 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.765 HG13 ' HB ' ' A' ' 90' ' ' THR . 5.6 mm -72.16 -37.49 59.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 110.413 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.848 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.7 mt-30 -54.2 -14.75 1.22 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.283 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.12 -36.66 22.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.843 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.47 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.43 -35.27 68.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.015 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.694 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.2 m-70 -121.91 162.09 38.86 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 -179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.07 72.3 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.625 2.217 . . . . 0.0 111.948 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.848 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 51.11 24.76 2.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.287 -179.37 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 9.1 mt -85.39 5.15 32.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.936 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.699 ' HB3' ' HG3' ' A' ' 79' ' ' GLN . . . -83.01 47.55 1.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.259 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -91.76 12.47 69.33 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.004 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.934 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 5.1 ttpt -177.58 -13.51 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.832 HG21 HG13 ' A' ' 115' ' ' VAL . 36.7 mt -49.85 -82.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.49 -38.12 63.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.509 0.195 . . . . 0.0 110.786 -178.834 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.65 -28.85 65.95 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.48 176.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.934 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.5 ttm -75.85 -38.24 58.19 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.458 0.647 . . . . 0.0 109.885 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.674 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -54.7 -9.55 0.35 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.486 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.894 HD11 HD13 ' A' ' 70' ' ' LEU . 5.0 mp -105.74 28.55 7.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.431 ' H ' ' H ' ' A' ' 96' ' ' ILE . 9.8 pt-20 -172.43 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.407 -178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.987 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.32 -150.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.323 0.583 . . . . 0.0 111.734 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -57.72 -5.7 0.42 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.858 177.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.559 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-20 79.62 -25.63 0.18 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.236 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.4 50.78 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.987 ' HB2' HG13 ' A' ' 96' ' ' ILE . 3.9 mt-10 -76.07 -24.28 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.776 177.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.707 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -75.2 -26.03 58.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.023 177.134 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 mp -90.72 -44.95 9.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.038 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.53 -41.65 96.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.04 -178.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.787 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.0 ptm -56.75 -37.5 71.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.812 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.842 HD23 HD13 ' A' ' 58' ' ' LEU . 56.5 mt -80.44 -11.61 59.66 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.232 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -4.4 14.38 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.761 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -144.2 134.65 12.08 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.164 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.574 ' O ' HG21 ' A' ' 54' ' ' THR . 7.8 Cg_exo -72.92 3.55 4.37 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.984 2.456 . . . . 0.0 111.671 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 113' ' ' SER . 28.5 mt-10 -126.15 -14.41 6.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.656 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.761 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -76.28 -47.21 24.57 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.002 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.881 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.78 -40.4 13.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.429 176.114 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 112' ' ' ARG . 0.3 OUTLIER -81.88 -65.53 1.0 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.573 -179.44 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.513 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -47.43 -49.72 24.52 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -178.479 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.5 mmtp -64.24 -30.96 71.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.193 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.832 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.78 -56.48 10.64 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.068 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.123 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -54.91 -35.68 64.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.021 0.438 . . . . 0.0 110.408 178.034 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.97 -32.05 61.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.088 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.623 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.4 -28.99 67.58 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.835 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.694 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -59.68 -49.02 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.158 0.504 . . . . 0.0 109.787 177.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.37 -25.92 51.21 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.701 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 9.9 t -86.64 -30.77 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.846 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.719 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.09 -41.02 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.996 179.275 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.481 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 15.1 mm100 -65.27 -35.06 79.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.004 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.52 177.678 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.785 0.326 . . . . 0.0 111.022 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.94 -174.95 3.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.585 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.51 -31.14 14.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.61 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -67.96 -46.85 70.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.865 0.364 . . . . 0.0 110.473 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.822 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.13 -38.12 75.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.787 178.373 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.641 ' HG ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -64.71 -43.52 93.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 178.159 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.89 -2.07 13.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.088 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 57' ' ' MET . 74.5 m -86.0 -8.5 57.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.886 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.336 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 179.392 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.447 ' O ' HD21 ' A' ' 70' ' ' LEU . 2.9 tt0 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.862 0.363 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.7 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -123.14 37.56 4.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.935 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -128.19 -50.26 1.31 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.679 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.551 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 15.4 mtm -74.46 10.17 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 111.726 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 1.058 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.57 -62.34 1.56 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.58 0.705 . . . . 0.0 110.391 -179.562 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.012 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -114.66 16.6 18.86 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 112.393 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.54 -8.18 4.63 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -125.97 -17.56 5.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.005 0.431 . . . . 0.0 110.816 -179.582 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.646 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.09 -10.98 59.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.633 -179.37 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.473 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 10.4 t80 -49.13 -54.04 32.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.771 -178.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.511 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 44.0 Cg_endo -67.29 -13.61 40.04 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.031 1.821 . . . . 0.0 112.079 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.821 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.0 mm? -86.39 -42.63 13.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.299 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.809 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.3 mm -60.95 -40.5 85.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.851 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.3 mt-30 -47.81 -20.45 0.3 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.024 -179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.21 -42.4 15.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.852 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.485 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -68.78 -39.98 79.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.62 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.886 ' CE1' HG21 ' A' ' 119' ' ' VAL . 6.2 m170 -123.5 155.82 65.13 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.932 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.49 ' HD2' HD12 ' A' ' 85' ' ' LEU . 24.6 Cg_exo -63.21 77.22 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 0.0 111.958 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 41.36 30.06 0.12 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.719 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.49 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.7 OUTLIER -85.41 8.38 19.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.779 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.809 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.56 12.55 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.874 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -52.95 -22.22 11.96 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.049 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.724 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -161.34 26.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.907 0.384 . . . . 0.0 111.275 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.872 HG21 HG13 ' A' ' 115' ' ' VAL . 62.8 mt -80.77 -87.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.199 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.012 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.91 -39.31 58.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.224 -179.42 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.15 -31.38 61.94 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.033 -1.08 . . . . 0.0 110.632 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.724 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.9 ttp -74.9 -34.31 62.16 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.081 -0.559 . . . . 0.0 110.083 177.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.685 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -58.37 -7.12 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.249 -177.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.058 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.6 mp -111.62 29.06 8.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 176.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 11.0 pt-20 -167.99 0.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.038 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 1.006 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.73 -148.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.488 0.661 . . . . 0.0 111.382 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -57.74 -6.29 0.5 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.7 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.741 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 78.57 -31.58 0.15 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.276 -179.302 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.52 -29.69 69.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.885 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 1.006 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -74.86 -35.52 62.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.107 177.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.631 ' HG ' HD12 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -65.32 -30.04 70.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.03 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.631 HD12 ' HG ' ' A' ' 101' ' ' LEU . 5.4 mp -81.79 -47.65 12.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.352 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -43.64 92.01 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.529 -177.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.827 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -55.92 -34.16 65.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.625 -179.078 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.663 HD21 ' HB3' ' A' ' 70' ' ' LEU . 21.2 mt -86.25 -11.4 52.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.841 0.353 . . . . 0.0 110.933 -179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.24 -6.52 17.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -177.217 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.774 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.37 139.12 16.16 Favored Pre-proline 0 C--N 1.332 -0.184 0 C-N-CA 120.454 -0.498 . . . . 0.0 112.153 -178.78 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.573 ' O ' HG21 ' A' ' 54' ' ' THR . 72.1 Cg_endo -75.78 2.81 6.6 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.606 2.204 . . . . 0.0 111.778 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -125.52 -12.95 6.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.345 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.69 -46.22 19.57 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 177.585 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.46 -40.62 18.69 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.393 176.149 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -79.32 -61.42 2.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.359 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 28.7 t -50.21 -53.13 30.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -178.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 3.7 mmtp -60.11 -29.8 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.373 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.872 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -72.91 -62.14 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.092 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 7.7 t0 -49.23 -35.12 16.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.995 0.426 . . . . 0.0 110.749 178.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -43.53 61.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.448 178.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.31 65.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.998 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.886 HG21 ' CE1' ' A' ' 82' ' ' HIS . 57.9 t -65.35 -45.88 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.688 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.87 -27.34 65.08 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.428 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 22.4 t -83.07 -33.2 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.477 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.448 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.41 -38.95 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.959 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -67.48 -28.69 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.019 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.204 179.074 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.723 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.838 0.352 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.789 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.69 -163.29 0.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.451 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -57.84 -40.24 79.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.447 -179.01 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 63.2 m -58.69 -45.69 88.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.871 0.367 . . . . 0.0 110.533 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.723 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.83 -42.2 97.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.28 178.687 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -58.21 -47.29 83.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.57 178.989 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.67 -10.35 51.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.326 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 57' ' ' MET . 41.5 t -82.45 -7.1 59.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.022 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.58 179.993 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.463 0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -111.8 24.06 13.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.86 178.827 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -118.62 -53.88 2.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.357 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.415 ' HE3' ' O ' ' A' ' 57' ' ' MET . 4.4 ptt? -81.08 3.82 22.0 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.843 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.21 -42.44 93.5 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.048 179.7 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.042 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.22 34.48 2.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.327 -0.939 . . . . 0.0 112.83 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.51 -3.43 0.72 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.959 0.409 . . . . 0.0 111.196 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.454 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -128.48 -21.56 3.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.117 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.59 -18.71 58.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.365 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -44.61 -56.14 9.0 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.97 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 60.0 Cg_endo -71.76 -8.96 24.1 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.054 1.836 . . . . 0.0 112.092 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.516 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 73.2 mt -97.34 -24.32 15.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.397 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -69.56 -36.91 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 177.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.5 mt-30 -51.6 -15.63 0.49 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.364 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -81.77 -42.61 19.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.611 178.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.697 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.75 -30.63 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.374 179.21 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.676 ' CE1' HG21 ' A' ' 119' ' ' VAL . 15.1 m170 -124.73 156.89 67.67 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.848 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.523 ' HD2' HD12 ' A' ' 85' ' ' LEU . 12.4 Cg_exo -67.7 73.86 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.297 1.998 . . . . 0.0 110.465 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.845 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.3 t 45.0 34.06 1.17 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.112 -177.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.523 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -84.73 2.6 41.25 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.329 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -77.07 60.89 1.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.81 -8.94 61.58 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 177.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.694 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.4 ttpt -176.49 30.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.14 -0.53 . . . . 0.0 110.54 179.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.813 HG21 HG13 ' A' ' 115' ' ' VAL . 64.2 mt -80.2 -90.81 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.323 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.042 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.48 -42.8 55.1 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.122 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.06 -32.7 50.13 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.304 -0.95 . . . . 0.0 111.137 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.725 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.08 -21.32 29.39 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 120.812 0.339 . . . . 0.0 110.405 179.175 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.659 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.0 mm? -61.48 -6.41 2.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.953 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.843 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -104.56 24.8 11.12 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.038 176.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.6 pt-20 -165.85 0.7 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.559 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.915 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.5 -153.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.519 0.676 . . . . 0.0 111.93 -179.593 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 96' ' ' ILE . 2.2 t70 -58.98 -3.92 0.41 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.17 177.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.84 -35.06 0.14 Allowed 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.156 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -66.14 -26.91 67.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.915 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -83.4 -24.68 31.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.503 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.2 tm? -74.86 -26.25 59.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.546 176.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.8 mp -88.75 -46.1 9.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.422 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -68.02 -36.25 79.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.644 -177.866 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.668 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 7.0 ptm -60.8 -34.92 75.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 110.941 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD23 ' A' ' 70' ' ' LEU . 27.5 mt -84.32 -13.77 51.51 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.799 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.67 -10.67 16.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.849 -177.75 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.829 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -139.37 131.88 15.33 Favored Pre-proline 0 C--N 1.33 -0.258 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.969 -178.665 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.597 ' O ' HG21 ' A' ' 54' ' ' THR . 7.1 Cg_exo -73.35 7.81 2.06 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.976 2.45 . . . . 0.0 111.859 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -127.59 -27.65 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.254 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.829 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.47 -49.26 74.34 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.789 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.8 tt -50.43 -32.9 19.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.31 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -59.32 2.34 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.379 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -57.28 -34.15 68.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.815 0.341 . . . . 0.0 111.175 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 20.0 mmtt -78.76 -29.2 45.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.354 179.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.813 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.46 -53.14 23.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.042 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.41 ' N ' HG12 ' A' ' 115' ' ' VAL . 22.8 t0 -56.85 -36.21 69.75 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.944 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -34.76 60.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.901 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.725 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -63.69 -29.94 71.1 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.446 177.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.676 HG21 ' CE1' ' A' ' 82' ' ' HIS . 23.6 t -55.46 -57.34 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.795 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.426 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -52.25 -24.51 7.44 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.416 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.414 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 10.7 t -87.02 -31.93 6.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.715 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.552 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -71.7 -43.12 66.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.918 178.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.552 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -67.06 -31.44 71.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.107 178.879 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.205 179.262 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.881 0.372 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -170.96 -177.14 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.968 178.308 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 1.014 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.84 -34.43 27.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -48.36 64.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.917 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.591 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -57.89 -41.12 81.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.194 0.521 . . . . 0.0 110.043 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.014 HD12 ' HA ' ' A' ' 55' ' ' ALA . 6.6 mt -63.91 -44.44 92.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.595 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -9.84 11.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.002 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.7 m -84.15 -8.84 58.97 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.999 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.506 179.72 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -99.26 34.91 2.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.1 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 49.4 mm-40 -133.17 -49.84 0.87 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.145 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.547 ' SD ' HD11 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -79.49 -7.73 58.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.909 -178.652 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.885 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -60.95 -34.56 74.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.658 0.266 . . . . 0.0 111.477 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.98 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -138.61 28.69 2.64 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.798 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -137.62 -7.31 1.7 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.866 0.365 . . . . 0.0 111.139 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -19.98 4.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.217 0.532 . . . . 0.0 109.837 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.664 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.44 -31.41 48.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.65 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.526 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.27 -53.49 5.23 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.142 -177.355 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 42.9 Cg_endo -68.21 -21.42 42.0 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.951 1.768 . . . . 0.0 112.138 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.485 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 92.0 mt -88.61 -19.76 25.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.316 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.736 HG13 ' HB ' ' A' ' 90' ' ' THR . 20.8 mm -71.73 -35.99 57.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.91 0.386 . . . . 0.0 110.135 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.487 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.1 OUTLIER -53.35 -17.15 1.66 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.424 0.63 . . . . 0.0 109.895 177.548 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.08 -38.57 27.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.621 178.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.482 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -69.8 -42.14 74.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.586 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.786 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.5 m-70 -122.25 152.0 59.89 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.953 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.652 ' HG2' HD12 ' A' ' 85' ' ' LEU . 19.8 Cg_endo -57.45 82.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.358 2.038 . . . . 0.0 111.565 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 14.1 t 40.16 37.63 0.42 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.416 -178.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -91.54 7.4 41.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.02 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.84 44.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.586 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.43 -11.64 84.94 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.536 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.639 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -175.57 32.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.851 HG21 HG13 ' A' ' 115' ' ' VAL . 70.7 mt -80.49 -89.44 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.026 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.98 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.17 -42.18 50.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.258 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.45 -31.44 57.12 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.078 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.639 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.96 -23.51 31.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 115.561 -0.319 . . . . 0.0 110.145 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.703 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -60.7 -9.06 3.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.403 178.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.885 HD11 HD13 ' A' ' 70' ' ' LEU . 4.8 mp -105.1 26.51 9.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.585 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 4.8 pt-20 -167.79 1.11 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.3 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.957 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.82 -154.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.486 0.66 . . . . 0.0 111.792 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.421 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.3 t0 -59.54 -2.82 0.38 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.201 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.537 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.79 -35.25 0.17 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.127 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 99' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -67.02 -25.82 66.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.89 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.957 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.9 mt-10 -84.18 -24.08 30.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.631 177.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.651 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.4 tp -74.82 -27.21 60.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.388 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -88.1 -47.86 8.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.091 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -63.81 -40.9 97.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.53 -178.586 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.816 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.7 ptm -56.4 -39.03 72.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.562 0.22 . . . . 0.0 111.218 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.765 HD23 HD13 ' A' ' 58' ' ' LEU . 4.5 mt -85.82 -7.55 58.66 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.167 0.508 . . . . 0.0 110.284 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -109.38 -6.51 15.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.966 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.717 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -147.06 129.79 7.87 Favored Pre-proline 0 C--N 1.328 -0.348 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.691 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.9 Cg_exo -67.78 1.32 3.35 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.78 2.32 . . . . 0.0 112.055 179.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.4 -11.22 6.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.527 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.717 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.92 -45.51 23.85 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.172 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.2 OUTLIER -46.59 -41.12 14.03 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.614 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.482 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 2.4 ttt180 -79.29 -62.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.306 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.4 t -49.74 -54.34 19.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.342 . . . . 0.0 111.221 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.793 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.2 mmtt -58.88 -29.84 67.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.338 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.851 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -73.92 -55.45 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.076 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.46 -33.15 63.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.059 0.457 . . . . 0.0 110.594 178.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -39.24 50.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.551 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.37 66.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.821 177.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.786 HG11 ' ND1' ' A' ' 82' ' ' HIS . 15.6 t -66.82 -50.96 60.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.926 177.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.26 -24.96 58.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.655 177.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.57 -32.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.635 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.35 -36.61 60.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.077 179.331 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.78 -39.44 94.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.41 177.504 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.855 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.872 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.88 179.14 5.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.709 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.582 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -48.39 -40.23 25.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.524 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.7 m -58.55 -47.96 82.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.975 0.417 . . . . 0.0 110.538 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.566 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.14 -42.93 86.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.179 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -59.64 -45.33 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.809 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.92 -12.16 34.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.338 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 m -76.46 -11.41 59.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.313 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.406 179.916 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 120.864 0.364 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.656 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.89 28.79 4.49 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.714 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -131.92 -58.76 0.96 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.077 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.741 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 0.1 OUTLIER -80.7 24.13 0.49 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.897 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -87.84 -42.61 12.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.39 0.614 . . . . 0.0 109.717 178.749 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.054 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -118.77 11.93 11.98 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.057 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -125.67 3.1 7.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.735 -0.232 . . . . 0.0 111.517 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.741 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.16 -33.02 2.68 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.957 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.855 HD22 HD12 ' A' ' 53' ' ' LEU . 2.6 mm? -56.84 -32.8 66.13 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.88 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 4.8 t80 -34.13 -62.58 0.37 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -173.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.88 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.9 Cg_exo -64.25 -17.96 61.58 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.906 1.737 . . . . 0.0 112.281 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.709 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.1 mt -98.53 -18.62 18.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.901 -0.591 . . . . 0.0 112.276 -177.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 8.7 mm -72.73 -46.44 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.937 0.399 . . . . 0.0 110.492 179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.678 ' HG2' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -52.65 -17.34 1.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.178 178.5 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.61 -37.41 36.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.712 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.31 -49.27 23.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.813 -179.321 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.695 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.9 m-70 -107.72 159.39 30.54 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.418 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.651 ' HD2' HD12 ' A' ' 85' ' ' LEU . 19.9 Cg_exo -65.39 72.17 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.524 2.15 . . . . 0.0 111.904 179.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.678 HG23 ' HG2' ' A' ' 79' ' ' GLN . 1.6 m 49.03 39.44 14.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.933 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.651 HD12 ' HD2' ' A' ' 83' ' ' PRO . 14.9 mt -95.83 9.15 41.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.276 -179.084 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.604 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.11 -140.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.718 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.511 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.27 -12.66 30.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.581 -0.819 . . . . 0.0 111.897 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.757 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -156.63 -23.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.786 HG21 HG13 ' A' ' 115' ' ' VAL . 56.9 mt -50.33 -84.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.227 -0.115 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.054 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -55.34 -36.84 66.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.674 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.03 -29.23 59.16 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.595 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.4 ttp -76.45 -35.65 58.36 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.019 -0.591 . . . . 0.0 109.672 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.732 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.6 mm? -58.62 -6.93 0.81 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.72 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.684 ' HA ' HD12 ' A' ' 101' ' ' LEU . 1.3 mm? -108.14 27.17 9.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.4 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -170.78 3.21 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.334 -178.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.896 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -151.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.346 0.593 . . . . 0.0 111.691 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.57 -2.59 0.36 Allowed 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.092 177.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 71.1 m-20 78.16 -27.84 0.16 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.377 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -31.5 60.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.001 0.429 . . . . 0.0 110.008 178.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.896 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.1 mt-10 -75.32 -23.71 57.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.786 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.805 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.04 -23.63 58.15 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.862 177.06 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.805 HD12 HD23 ' A' ' 101' ' ' LEU . 2.4 mp -92.47 -42.45 9.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.266 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.53 -39.55 85.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.273 -178.67 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.846 ' HB2' HD22 ' A' ' 111' ' ' LEU . 6.3 ptm -57.68 -33.61 68.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD13 ' A' ' 70' ' ' LEU . 12.6 mt -87.15 -10.54 52.46 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.917 -179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.93 -8.1 14.52 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -177.317 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.694 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -139.9 132.64 15.04 Favored Pre-proline 0 C--N 1.33 -0.263 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.883 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 61.1 Cg_endo -72.03 4.56 3.15 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.663 2.242 . . . . 0.0 112.03 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 113' ' ' SER . 65.4 mt-10 -127.3 -13.09 5.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.494 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.694 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.51 -46.91 20.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.038 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.872 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.93 -40.7 14.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -66.1 0.93 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 3.9 m -47.06 -47.7 22.58 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.737 0.304 . . . . 0.0 111.429 -178.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 9.4 mmtt -64.69 -33.47 76.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.786 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -69.16 -55.05 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.3 t70 -54.04 -38.16 64.91 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.95 0.405 . . . . 0.0 110.456 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -75.2 -31.19 60.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.128 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.77 -21.21 62.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.946 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.695 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -67.77 -48.78 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.581 0 N-CA-C 109.479 -0.564 . . . . 0.0 109.479 176.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.6 -22.65 56.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.101 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 43.1 t -86.46 -33.99 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.46 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.757 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.97 -38.68 72.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.606 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -69.67 -28.85 66.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.907 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.97 179.108 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.754 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.794 0.33 . . . . 0.0 111.015 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.844 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.56 -165.5 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.2 179.321 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -55.93 -38.21 69.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -60.09 -47.19 86.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.51 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.754 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.17 -43.78 87.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.178 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -57.24 -48.68 78.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.545 178.972 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.14 -3.58 20.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 57' ' ' MET . 36.2 t -88.26 -7.48 56.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.665 -179.92 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.975 0.417 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.431 ' H ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -105.26 36.51 2.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.51 178.507 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -136.06 -63.56 0.64 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.032 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.502 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 3.3 ptt? -81.44 22.53 0.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.942 ' H ' HD23 ' A' ' 70' ' ' LEU . 1.2 pt? -79.83 -43.47 22.32 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.889 -0.325 . . . . 0.0 111.18 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.008 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -140.49 31.84 2.2 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.331 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -140.66 -7.83 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.653 0.263 . . . . 0.0 111.241 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.27 -14.36 5.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.596 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -75.48 -15.61 60.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.212 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.676 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -47.29 -56.27 13.05 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.781 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.676 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 34.8 Cg_exo -60.35 -11.94 18.38 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.04 1.826 . . . . 0.0 112.272 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.588 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.7 mm? -98.47 -29.05 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.65 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.759 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.2 mm -65.47 -38.11 81.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 120.773 0.321 . . . . 0.0 111.185 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.941 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 20.2 mt-30 -52.02 -17.72 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.578 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.7 -37.25 22.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.276 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.759 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.24 -35.72 61.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.068 0.461 . . . . 0.0 110.682 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.791 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -126.08 155.84 72.86 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.696 -179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.558 ' HD2' HD12 ' A' ' 85' ' ' LEU . 25.1 Cg_exo -62.37 74.32 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.493 2.129 . . . . 0.0 111.854 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.941 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.2 p 48.37 31.4 2.72 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.987 -178.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -83.67 4.97 26.26 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.17 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.66 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.89 -138.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.878 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.24 -16.4 23.41 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.667 -0.777 . . . . 0.0 111.683 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.889 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.7 ttpt -156.02 -20.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.84 HG21 HG13 ' A' ' 115' ' ' VAL . 60.0 mt -50.35 -81.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.008 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.27 -39.79 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.513 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.96 -28.11 60.43 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 176.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.889 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.6 ttm -76.71 -38.1 54.94 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.41 0.624 . . . . 0.0 109.617 176.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -57.85 -5.82 0.46 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.334 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.862 HD21 ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.6 27.37 9.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.569 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.461 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -170.14 1.29 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.211 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.945 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.18 -152.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.402 0.62 . . . . 0.0 111.654 -179.793 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 96' ' ' ILE . 1.8 t70 -59.58 -3.22 0.44 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.058 177.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.608 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.15 -34.91 0.16 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 123.733 0.645 . . . . 0.0 111.234 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -29.18 68.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.938 178.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.945 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -79.67 -26.23 41.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.802 177.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.561 HD12 HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -74.82 -27.17 60.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.618 176.911 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.88 -46.87 10.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.301 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.9 -39.94 87.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.118 -178.648 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.776 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -56.52 -34.13 66.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.521 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 23.0 mt -85.67 -12.98 49.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.506 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -107.8 -2.05 20.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.37 -177.323 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.808 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -150.07 132.64 8.14 Favored Pre-proline 0 CA--C 1.53 0.207 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 54' ' ' THR . 16.6 Cg_exo -68.48 -1.66 7.8 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.933 2.422 . . . . 0.0 112.139 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -116.96 -29.38 6.01 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.057 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.808 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -62.11 -42.19 98.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.203 -178.99 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.844 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.8 tt -59.77 -25.39 64.86 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.669 -0.413 . . . . 0.0 111.176 179.303 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.7 mtp180 -95.92 -66.09 0.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.923 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.53 ' HG ' ' HG3' ' A' ' 109' ' ' GLU . 1.5 m -42.82 -33.99 0.86 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.961 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 38.7 mmtt -81.77 -43.26 18.6 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.144 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.84 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.19 -58.4 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.49 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.46 -41.75 53.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.19 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -73.17 -31.07 64.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.066 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.799 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.29 -27.71 66.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.63 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.791 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.4 t -59.41 -53.15 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.611 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -54.27 -23.68 15.88 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.065 177.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 12.3 t -86.71 -30.96 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.65 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.793 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.51 -41.18 61.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.208 179.059 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.541 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -70.17 -28.71 65.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.401 0.62 . . . . 0.0 110.078 179.156 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.649 179.93 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.813 0.34 . . . . 0.0 110.972 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.874 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -167.52 -175.42 2.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.305 179.401 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.14 -34.14 21.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.278 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 20.0 m -64.01 -44.79 91.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.627 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.823 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.25 -42.04 97.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.207 178.858 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -61.88 -44.5 96.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.759 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.71 -12.41 58.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.292 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.2 m -76.92 -16.77 59.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.059 179.549 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.861 0.362 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HA ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -117.29 41.33 2.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.743 179.339 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -136.46 -54.66 0.74 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.281 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.446 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.3 ptt? -80.54 -1.84 43.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.784 -178.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.81 -43.12 99.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.591 0.234 . . . . 0.0 111.559 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.986 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.48 28.24 3.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.349 -0.929 . . . . 0.0 112.684 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -140.91 -2.97 1.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 0.0 111.194 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.35 -23.1 3.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.059 0.457 . . . . 0.0 110.721 -179.819 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.04 -22.47 59.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.812 -178.894 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.679 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -44.95 -56.35 9.08 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.968 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.679 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.1 Cg_exo -61.12 -15.14 37.65 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.031 1.821 . . . . 0.0 112.371 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.725 HD12 ' HB2' ' A' ' 53' ' ' LEU . 82.9 mt -98.64 -25.51 14.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.909 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.7 mm -65.23 -38.64 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-O 121.009 0.433 . . . . 0.0 110.667 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.709 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.0 mt-30 -53.64 -14.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.827 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -88.2 -30.46 19.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.189 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.493 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -84.0 -46.63 11.83 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -173.554 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.771 ' N ' ' HA ' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -80.64 -35.57 0.86 Allowed Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 -171.309 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.771 ' HA ' ' N ' ' A' ' 82' ' ' HIS . 42.1 Cg_endo -96.41 -76.24 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.028 0 CA-C-N 120.65 1.268 . . . . 0.0 112.675 2.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.709 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.9 m -68.08 76.46 0.23 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.696 -178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 84' ' ' THR . 0.4 OUTLIER -145.68 10.33 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.43 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.601 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.79 42.43 0.3 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.448 -177.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -12.59 64.28 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.045 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.807 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.8 ttpt 177.04 36.9 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.042 0.449 . . . . 0.0 110.091 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.903 HG21 HG13 ' A' ' 115' ' ' VAL . 67.4 mt -79.72 -90.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.169 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.986 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.3 -39.62 57.27 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.26 -32.17 57.1 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.02 -1.085 . . . . 0.0 110.838 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.807 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.69 -25.57 32.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.367 178.637 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.617 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.3 mm? -59.6 -7.92 1.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.732 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 70' ' ' LEU . 1.8 mm? -106.19 27.33 8.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.5 pt-20 -166.43 1.53 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.463 -178.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.968 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.83 -151.48 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.384 0.611 . . . . 0.0 111.73 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.541 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.2 t0 -59.08 -3.83 0.42 Allowed 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.085 178.06 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-80 79.55 -29.03 0.14 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.544 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -32.6 61.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.168 0.509 . . . . 0.0 109.827 178.22 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.968 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.8 mt-10 -74.08 -23.49 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.999 177.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.477 ' CB ' HD11 ' A' ' 96' ' ' ILE . 1.5 tp -74.86 -25.64 59.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.863 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -88.27 -47.05 8.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.239 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.517 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.4 OUTLIER -63.12 -41.26 99.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.055 -178.912 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.862 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.6 OUTLIER -56.1 -34.0 65.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.348 -179.736 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.557 ' HA ' HD23 ' A' ' 58' ' ' LEU . 15.0 mt -87.15 -8.63 56.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.039 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 2.6 pt-20 -111.85 -7.98 14.15 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.68 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.42 131.7 14.08 Favored Pre-proline 0 C--N 1.331 -0.196 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.782 -179.134 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.575 ' O ' HG21 ' A' ' 54' ' ' THR . 16.7 Cg_exo -67.58 1.2 3.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.808 2.339 . . . . 0.0 112.103 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -127.19 -11.69 5.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.5 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.68 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -75.24 -46.16 35.6 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.292 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.874 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.48 -29.83 3.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.653 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -95.22 -64.06 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.076 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 27.8 t -46.24 -31.56 2.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.967 0.413 . . . . 0.0 109.981 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 15.8 mmtm -80.75 -41.05 24.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.88 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.903 HG13 HG21 ' A' ' 89' ' ' ILE . 1.5 t -64.38 -63.0 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.305 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.511 ' N ' HG12 ' A' ' 115' ' ' VAL . 9.6 t70 -48.84 -40.07 27.97 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 111.081 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.0 -35.61 66.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.796 0.332 . . . . 0.0 110.454 179.49 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.28 68.29 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.834 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.826 HG13 HD23 ' A' ' 122' ' ' LEU . 12.9 t -63.79 -47.76 89.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.141 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.58 37.09 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.455 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.8 t -87.13 -34.54 7.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.062 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.826 HD23 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -65.58 -33.56 76.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.335 178.209 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -79.82 -24.76 41.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.703 177.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.243 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.794 178.233 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.95 HD22 ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.891 0.377 . . . . 0.0 111.186 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.884 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.95 -168.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.331 179.308 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -54.79 -38.91 67.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.507 -179.518 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.42 -45.92 91.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 0.0 110.419 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.849 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.49 -43.14 88.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.065 178.688 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.15 -48.16 81.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.476 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.01 -2.6 15.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.355 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' ' 57' ' ' MET . 27.7 t -88.99 -6.98 56.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.315 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.717 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -120.58 30.34 6.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.804 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -131.69 -53.6 1.0 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.437 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.567 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -77.26 2.4 15.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.674 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.747 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -68.4 -39.49 81.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.611 -179.759 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.069 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.4 27.76 2.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.591 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -139.59 -10.16 1.22 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.618 0.247 . . . . 0.0 111.27 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.579 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.9 tmt_? -127.35 -14.82 5.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.307 . . . . 0.0 110.774 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.95 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.77 -14.63 59.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.484 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.643 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 5.6 t80 -49.39 -55.03 24.35 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.531 -178.294 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.4 Cg_exo -61.69 -9.35 13.51 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.083 1.855 . . . . 0.0 112.455 -179.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.69 -35.41 10.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.699 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.7 mm -60.09 -40.72 84.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.855 0.359 . . . . 0.0 110.601 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.779 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.2 mt-30 -49.19 -19.16 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.879 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.63 -41.63 17.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.908 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.449 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.31 -38.72 75.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.331 0.586 . . . . 0.0 110.412 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.717 ' CE1' HG21 ' A' ' 119' ' ' VAL . 5.3 m170 -121.71 148.69 51.37 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.442 -177.469 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.809 ' HD2' HD12 ' A' ' 85' ' ' LEU . 37.8 Cg_exo -60.33 74.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.441 2.094 . . . . 0.0 111.699 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.779 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.7 OUTLIER 48.83 28.33 1.88 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.643 -178.048 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.809 HD12 ' HD2' ' A' ' 83' ' ' PRO . 3.1 mt -80.69 2.41 26.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.146 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -68.05 -131.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.585 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.58 -18.55 6.97 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.045 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.864 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.3 ttpt -156.34 -20.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 70.1 mt -49.81 -79.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.069 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.78 -40.14 69.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.457 0.17 . . . . 0.0 110.824 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.33 -28.39 61.79 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.097 -1.049 . . . . 0.0 110.57 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.864 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.0 ttm -76.12 -36.69 58.72 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.581 0.705 . . . . 0.0 109.79 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.691 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -56.27 -9.47 0.67 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.619 -178.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.747 HD21 HD13 ' A' ' 70' ' ' LEU . 2.4 mm? -106.32 28.34 7.84 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 176.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.7 pt-20 -170.26 0.35 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.662 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.956 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.88 -148.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.464 0.65 . . . . 0.0 111.493 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -53.92 -10.14 0.3 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.99 176.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.698 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.5 m-80 79.87 -22.95 0.25 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.099 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -32.35 59.38 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.403 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.956 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -70.48 -29.89 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.864 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.695 HD23 HD22 ' A' ' 94' ' ' LEU . 2.2 tm? -69.36 -27.31 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.197 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.4 mp -87.96 -46.58 9.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.348 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.485 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.12 -39.83 90.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.567 -177.821 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.784 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.3 ptm -57.19 -35.87 70.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.715 0.293 . . . . 0.0 111.122 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.55 ' HA ' HD23 ' A' ' 58' ' ' LEU . 12.5 mt -85.7 -10.09 56.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.9 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.485 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -109.55 -8.51 14.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.175 -177.515 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.708 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -140.31 131.49 14.12 Favored Pre-proline 0 C--N 1.33 -0.276 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.865 -178.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 14.9 Cg_exo -69.14 2.4 3.21 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.978 2.452 . . . . 0.0 112.029 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -127.3 -11.99 5.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.671 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.708 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -77.16 -45.57 26.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.884 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.64 -41.21 14.37 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.779 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.6 -63.27 1.45 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.296 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -48.71 -55.11 12.31 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.348 . . . . 0.0 111.076 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 17.9 mmtt -57.6 -31.28 66.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.36 -58.63 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.204 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 115' ' ' VAL . 23.3 t70 -49.62 -38.92 33.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.285 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -43.99 68.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.187 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.724 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -58.4 -29.05 65.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.936 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.717 HG21 ' CE1' ' A' ' 82' ' ' HIS . 21.6 t -56.91 -51.5 67.4 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.789 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.02 -26.91 28.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.92 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.416 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 9.2 t -86.18 -31.03 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.875 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.76 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.92 -40.71 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.908 179.259 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 16.9 mm100 -61.97 -37.91 86.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.653 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.235 176.641 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.824 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.927 0.394 . . . . 0.0 111.014 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -164.64 -167.92 1.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.329 179.388 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.516 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -56.84 -37.44 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.093 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.1 m -61.12 -43.61 98.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.389 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.824 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -62.26 -41.49 98.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.149 178.55 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -59.25 -46.13 89.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.546 179.151 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.99 -12.17 61.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.3 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 28.5 t -76.37 -8.63 57.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.832 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.549 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.329 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 121.05 0.452 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.625 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -130.32 25.08 5.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 179.62 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.488 ' N ' HD21 ' A' ' 70' ' ' LEU . 40.7 tt0 -130.25 -58.02 1.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.92 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.631 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -74.0 18.02 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.13 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.626 ' N ' HD23 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -89.41 -39.46 13.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.119 0.485 . . . . 0.0 110.491 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.05 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.74 16.41 5.34 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.198 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -133.84 -11.09 2.67 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.477 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.585 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.77 -14.05 5.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.843 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.76 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.82 -12.06 59.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.131 179.392 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.735 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.1 t80 -46.81 -54.29 20.66 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.024 -178.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.735 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.1 Cg_exo -62.67 -15.62 47.54 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.205 1.937 . . . . 0.0 112.286 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.637 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.2 mm? -93.25 -28.13 16.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.486 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.771 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.0 mm -70.61 -40.18 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.781 0.324 . . . . 0.0 111.187 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.807 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 17.8 mt-30 -53.29 -16.43 1.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.346 0.593 . . . . 0.0 110.22 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.83 -37.23 22.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.062 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.771 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.17 -35.96 61.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.046 0.45 . . . . 0.0 110.704 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.9 m-70 -125.24 161.98 46.7 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.861 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.81 ' HG2' HD13 ' A' ' 85' ' ' LEU . 45.7 Cg_endo -67.59 72.16 0.66 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.402 2.068 . . . . 0.0 112.041 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.807 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 66.1 p 46.83 41.89 11.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.356 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.81 HD13 ' HG2' ' A' ' 83' ' ' PRO . 2.3 mp -99.15 11.06 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.69 22.33 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.986 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.04 -17.15 35.74 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.657 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.3 ttpt -168.95 29.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.816 0.341 . . . . 0.0 111.06 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.884 HG21 HG13 ' A' ' 115' ' ' VAL . 67.5 mt -80.7 -90.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.07 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.05 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -52.04 -41.73 62.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.07 -32.31 49.64 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.113 -1.042 . . . . 0.0 111.146 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.685 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.69 -22.39 27.87 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 120.908 0.385 . . . . 0.0 110.45 179.437 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.586 ' HA ' HG23 ' A' ' 96' ' ' ILE . 3.9 mm? -60.22 -10.01 4.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.195 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.638 HD23 ' HA3' ' A' ' 71' ' ' GLY . 2.2 mm? -102.91 26.43 8.13 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.3 pt-20 -165.5 -0.62 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.916 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.94 -151.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.397 0.618 . . . . 0.0 111.633 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.7 t0 -53.83 -10.05 0.28 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.151 176.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.751 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.8 OUTLIER 79.16 -23.03 0.26 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.191 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -76.53 -25.98 54.72 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -77.96 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.779 177.265 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.776 ' HG ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.5 -21.41 66.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.865 178.094 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.776 HD23 ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -88.68 -52.4 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.23 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.6 OUTLIER -63.36 -38.75 92.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.223 -178.56 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.78 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -56.85 -35.1 68.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.743 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.567 HD21 HD13 ' A' ' 70' ' ' LEU . 21.7 mt -86.89 -10.15 54.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.942 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.18 -4.64 15.65 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -177.029 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.815 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -141.93 130.0 11.81 Favored Pre-proline 0 C--N 1.332 -0.192 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.597 -179.918 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.536 ' O ' HG21 ' A' ' 54' ' ' THR . 21.9 Cg_exo -66.47 6.25 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.402 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.4 OUTLIER -131.54 -24.25 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.538 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.815 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.13 -42.62 99.54 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.995 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.76 -28.55 2.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.357 175.706 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.9 mtp85 -95.89 -66.63 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.073 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 22.7 t -44.93 -30.36 0.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.306 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -80.79 -42.27 22.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.953 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.884 HG13 HG21 ' A' ' 89' ' ' ILE . 1.9 t -64.25 -60.18 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.279 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.436 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.5 OUTLIER -51.31 -39.61 57.25 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.078 179.442 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.512 ' HB2' ' O ' ' A' ' 113' ' ' SER . 2.1 mt-10 -73.21 -33.9 65.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.916 0.388 . . . . 0.0 110.151 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.685 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.08 -27.46 67.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.668 HG11 ' ND1' ' A' ' 82' ' ' HIS . 22.0 t -60.57 -47.46 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.05 -25.9 59.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.557 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.56 -31.26 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.799 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.6 -40.08 66.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.927 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -64.02 -38.59 91.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.94 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.396 177.221 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.513 HD12 ' CD1' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.863 0.363 . . . . 0.0 111.033 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.916 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -169.8 -177.81 2.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.175 178.312 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.953 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.32 -35.79 51.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.479 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 5.7 m -66.58 -47.91 71.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.364 . . . . 0.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.586 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.17 -41.98 85.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.258 0.551 . . . . 0.0 110.369 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.953 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.1 mt -63.17 -45.94 89.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.812 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.58 -10.34 44.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.488 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -83.15 -8.02 59.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.736 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.182 179.939 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.96 0.41 . . . . 0.0 110.497 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -116.51 36.03 4.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.577 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -126.76 -50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.421 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.481 ' HG3' HD23 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -80.62 -3.38 50.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.642 -178.668 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.771 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.09 -38.57 86.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.39 -179.767 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.94 28.91 2.78 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.581 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -142.95 0.18 1.19 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.428 ' CB ' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -130.37 -22.62 2.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.692 179.157 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -75.98 -24.88 55.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.826 178.857 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.467 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -41.14 -55.96 4.58 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.044 -177.931 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.0 Cg_endo -71.48 -15.37 30.94 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.028 1.819 . . . . 0.0 112.232 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 81.3 mt -92.16 -20.64 21.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.524 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.71 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.6 mm -73.08 -36.17 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HG2' HG22 ' A' ' 84' ' ' THR . 3.7 mt-30 -52.8 -13.06 0.37 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.097 177.082 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -84.09 -44.42 14.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.9 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.71 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.45 -35.78 73.53 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.526 0.679 . . . . 0.0 110.164 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.683 ' ND1' HD13 ' A' ' 89' ' ' ILE . 5.5 m170 -119.53 139.91 28.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.944 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.429 ' O ' HG23 ' A' ' 84' ' ' THR . 54.7 Cg_exo -30.98 -48.91 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.82 2.347 . . . . 0.0 112.215 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.627 HG22 ' HG2' ' A' ' 79' ' ' GLN . 0.0 OUTLIER 176.59 14.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.89 177.509 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.86 3.87 0.97 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.424 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.729 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.32 47.37 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.247 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.78 -7.32 78.48 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.943 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 4.8 ttpt -174.4 28.35 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.783 0.325 . . . . 0.0 110.977 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 56.1 mt -80.1 -83.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.757 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.1 -40.88 59.43 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.476 0.179 . . . . 0.0 110.669 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.14 -31.76 56.46 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.943 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 4.6 ttm -73.8 -39.34 64.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.272 176.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -54.18 -10.76 0.39 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.843 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.771 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -105.15 28.68 7.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -171.52 -0.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.04 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.996 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.92 -150.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.488 0.661 . . . . 0.0 111.735 -179.325 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.6 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.7 t70 -55.49 -9.35 0.47 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.204 176.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.733 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.3 m120 79.45 -24.64 0.2 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.103 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -74.32 -29.35 61.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.996 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.57 -38.53 62.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.556 176.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.571 ' N ' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -64.23 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.986 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.36 -48.62 7.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.203 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.453 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.1 -41.43 94.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.318 -178.299 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.839 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -56.32 -34.31 66.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.443 -179.354 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.668 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.2 mt -86.66 -11.22 51.95 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.797 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.16 -7.99 15.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.737 0.644 . . . . 0.0 112.737 -176.68 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -141.95 135.73 14.63 Favored Pre-proline 0 C--N 1.332 -0.164 0 C-N-CA 120.598 -0.441 . . . . 0.0 112.008 -178.69 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.503 ' O ' HG21 ' A' ' 54' ' ' THR . 62.5 Cg_endo -72.18 0.52 7.19 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.697 2.265 . . . . 0.0 111.906 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -123.99 -10.89 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.323 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.81 -46.89 17.75 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.095 0.474 . . . . 0.0 109.737 178.059 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.916 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.5 -39.62 16.49 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.163 176.336 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.425 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.5 ttt-85 -80.18 -59.2 2.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.273 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.425 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 3.3 t -52.66 -56.82 12.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.981 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.595 ' HD3' ' HG3' ' A' ' 100' ' ' GLU . 0.8 OUTLIER -55.21 -32.24 62.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.8 t -69.58 -60.96 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.079 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.435 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.7 OUTLIER -50.24 -36.8 32.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 111.176 178.767 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -38.99 65.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.263 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.635 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -61.85 -30.02 70.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 177.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 115' ' ' VAL . 14.6 t -56.2 -53.74 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.933 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.44 -27.07 22.78 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.928 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 9.2 t -85.68 -31.71 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.954 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -70.82 -43.39 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.815 179.211 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.508 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 18.1 mm100 -68.88 -25.6 64.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.214 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.354 179.264 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.841 HD22 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.007 0.432 . . . . 0.0 111.164 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.68 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.33 -169.06 1.01 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.682 178.916 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 1.017 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -53.52 -40.26 65.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.665 0.269 . . . . 0.0 111.431 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.5 m -59.27 -51.54 69.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.715 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.581 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.56 -39.11 79.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.296 179.069 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 55' ' ' ALA . 17.8 mt -62.9 -42.89 99.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.89 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.2 -16.72 62.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.148 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.9 m -74.19 -7.21 51.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.357 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.397 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.483 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.08 25.22 12.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 178.856 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 2.2 mm100 -121.58 -50.76 2.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -81.17 5.97 15.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.92 -178.915 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.799 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.86 -57.27 8.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 179.816 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.007 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -113.05 33.62 5.49 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.732 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -144.41 -3.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.824 0.345 . . . . 0.0 111.297 -178.686 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.659 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -125.68 -26.26 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.527 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.841 HD22 HD22 ' A' ' 53' ' ' LEU . 1.6 mm? -63.5 -33.14 74.92 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.297 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.796 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.2 t80 -39.2 -60.23 1.27 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.796 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 32.5 Cg_exo -57.92 -19.45 39.8 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 121.851 1.701 . . . . 0.0 112.342 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.537 HD23 ' HB2' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -98.83 -25.96 14.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.318 -178.109 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.679 HG12 ' O ' ' A' ' 74' ' ' LEU . 5.4 mm -65.85 -40.03 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.782 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -51.5 -19.36 1.4 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.521 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.26 -36.85 26.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.837 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.49 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.79 -34.56 64.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.6 m-70 -130.44 148.03 68.3 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.572 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 85' ' ' LEU . 51.2 Cg_exo -55.65 79.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.537 2.158 . . . . 0.0 112.364 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.782 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.0 p 42.89 37.68 1.17 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.529 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 10.8 mt -95.66 12.46 29.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.1 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.471 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.02 24.16 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.558 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.18 -19.14 44.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.681 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.644 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -169.11 32.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.89 0.376 . . . . 0.0 111.012 179.681 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.805 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -80.56 -92.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.888 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.007 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.82 -40.56 56.02 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.01 -31.33 55.78 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.209 -0.996 . . . . 0.0 110.973 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.709 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.79 -22.16 29.67 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 120.864 0.364 . . . . 0.0 110.098 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -62.48 -4.41 1.9 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.195 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -106.61 24.32 12.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.131 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.465 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 10.5 pt-20 -166.8 0.83 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.481 -178.746 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -152.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.554 0.693 . . . . 0.0 111.797 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.459 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.4 t0 -59.27 -3.28 0.38 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.157 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.62 -34.07 0.14 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.244 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 99' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -69.18 -24.79 64.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.102 178.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.904 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.3 mt-10 -84.04 -27.05 28.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.427 177.253 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.1 OUTLIER -74.89 -27.48 60.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.246 175.886 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.434 HD23 HD23 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -83.92 -48.79 9.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.873 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.534 ' ND1' ' HB3' ' A' ' 110' ' ' SER . 0.2 OUTLIER -61.93 -47.74 83.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.422 -178.57 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.716 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 5.7 ptm -52.15 -36.44 51.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.455 -178.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.81 HD23 HD13 ' A' ' 58' ' ' LEU . 54.4 mt -81.83 -14.71 55.94 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.857 -179.211 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.479 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.2 -10.61 16.38 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -176.934 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.534 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -143.2 136.27 13.86 Favored Pre-proline 0 N--CA 1.465 0.278 0 C-N-CA 120.283 -0.567 . . . . 0.0 112.241 -178.62 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.561 ' O ' HG21 ' A' ' 54' ' ' THR . 7.6 Cg_exo -73.69 3.88 4.52 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.017 2.478 . . . . 0.0 112.156 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -123.99 -22.07 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.561 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.534 ' HB3' ' ND1' ' A' ' 103' ' ' HIS . 2.4 p -64.05 -55.97 18.32 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.377 0.608 . . . . 0.0 109.857 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.5 tt -48.8 -31.09 6.48 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.572 -179.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.2 ttt85 -88.17 -60.56 1.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.308 -179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.4 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 49.6 m -56.5 -34.75 67.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.122 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -78.5 -31.22 47.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.78 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.805 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.77 -51.71 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.31 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -32.96 69.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.336 177.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -79.58 -31.07 41.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.574 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.709 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -68.32 -23.77 64.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.492 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 17.0 t -64.86 -57.24 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.609 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -53.27 -23.78 9.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.885 177.64 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 24.2 t -86.62 -32.54 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.433 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.68 -43.87 65.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.234 179.207 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.549 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -66.19 -31.5 72.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.829 178.327 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.139 179.133 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.793 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.824 0.345 . . . . 0.0 110.841 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -169.44 -161.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.37 179.229 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.6 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -58.26 -35.38 71.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.394 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 72.9 m -60.39 -49.43 77.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.223 179.156 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.793 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.22 -42.34 86.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.306 178.659 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.616 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.93 -45.11 91.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.815 179.459 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.27 -16.07 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.337 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.5 t -75.95 -13.52 60.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.744 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.993 179.497 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.9 0.381 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -118.87 39.69 3.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.785 179.55 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -135.82 -59.27 0.76 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.371 -179.572 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -79.89 12.48 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.859 -178.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.807 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -76.62 -40.56 48.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.748 0.309 . . . . 0.0 111.077 179.052 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.047 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -133.7 23.98 3.72 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.224 -0.989 . . . . 0.0 112.693 -179.276 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.61 -7.37 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.708 0.29 . . . . 0.0 111.225 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.8 tmt_? -127.13 -15.25 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.906 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.673 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.11 -8.86 58.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.228 179.524 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.711 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.1 t80 -50.02 -55.82 21.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.445 -178.516 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 19.9 Cg_exo -64.89 -9.64 22.11 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.057 1.838 . . . . 0.0 111.852 179.513 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.784 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.9 mm? -93.22 -34.21 13.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.365 -179.52 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.778 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.5 mm -66.74 -38.87 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.872 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.729 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.4 mt-30 -50.93 -18.25 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.444 0.64 . . . . 0.0 110.198 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -83.82 -43.11 15.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.225 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.71 -38.73 73.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.427 0.632 . . . . 0.0 110.424 -179.898 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.659 ' ND1' HD13 ' A' ' 89' ' ' ILE . 3.9 m170 -121.95 151.24 57.75 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.414 -177.132 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.826 ' HG2' HD23 ' A' ' 85' ' ' LEU . 30.5 Cg_endo -62.58 75.82 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.272 1.982 . . . . 0.0 111.778 179.544 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.729 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 50.43 28.85 3.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.743 -178.786 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.826 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -80.22 0.62 31.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.375 -178.897 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.756 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.78 -144.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.47 -3.58 86.12 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.915 -179.441 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.73 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -167.82 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.778 -0.211 . . . . 0.0 111.111 -179.826 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.836 HG21 HG13 ' A' ' 115' ' ' VAL . 76.6 mt -49.68 -82.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.689 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.047 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -55.57 -38.12 68.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.597 0.237 . . . . 0.0 110.729 179.748 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.54 -29.05 57.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.686 177.34 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.591 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.3 ttp -76.88 -33.62 57.82 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.098 -0.551 . . . . 0.0 109.876 177.374 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.553 ' O ' HD23 ' A' ' 101' ' ' LEU . 4.6 mm? -59.86 -5.2 0.88 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.642 -178.215 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.807 HD11 HD13 ' A' ' 70' ' ' LEU . 3.2 mp -109.08 25.78 11.4 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 176.483 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -169.91 3.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.289 -178.391 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.942 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.06 -151.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.242 0.544 . . . . 0.0 111.66 -179.752 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 6.3 t0 -59.53 -2.48 0.34 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.206 178.308 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-80 78.0 -28.74 0.16 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.443 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 m -75.32 -27.05 59.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.054 0.454 . . . . 0.0 109.888 178.092 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.942 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -80.41 -22.19 41.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.938 177.916 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.1 tm? -75.2 -24.98 57.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.723 176.73 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.3 mp -90.25 -45.14 9.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.359 -179.21 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.09 -36.79 80.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.007 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.632 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.87 -36.03 73.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 179.785 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.616 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.7 mt -87.01 -10.47 53.05 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.186 0.517 . . . . 0.0 109.991 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -108.02 -3.46 18.72 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.157 -176.493 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -150.75 131.46 7.22 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.204 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.485 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.03 -2.02 8.04 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.931 2.42 . . . . 0.0 112.064 179.509 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.463 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -117.31 -28.52 6.12 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.343 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.821 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -62.63 -42.93 99.87 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.469 -178.887 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.9 tt -61.25 -30.6 70.55 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.281 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.528 ' HG2' ' N ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -89.48 -63.52 1.27 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 0.0 110.5 180.0 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.528 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 2.7 m -49.41 -36.85 23.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.386 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.473 ' HD2' ' OE2' ' A' ' 100' ' ' GLU . 33.3 mmtt -80.1 -35.71 36.47 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.044 178.794 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.836 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.59 -50.23 81.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.561 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.82 -37.16 68.29 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.094 178.304 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -39.67 69.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.85 178.487 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.66 -25.97 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 115' ' ' VAL . 17.0 t -59.68 -53.94 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.496 176.638 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.23 -26.37 28.3 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.918 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.76 -31.03 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.918 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.73 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.95 -41.36 62.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 110.014 179.27 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.533 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 34.7 mm-40 -63.37 -34.3 77.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.879 178.555 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.437 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.678 177.734 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.695 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.679 0.276 . . . . 0.0 110.811 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.902 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -163.03 -177.19 5.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.771 179.442 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.08 -38.0 36.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.066 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.1 m -61.44 -45.14 95.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.489 179.333 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.695 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.46 -43.38 96.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.057 178.692 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.96 -46.2 88.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.619 179.345 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.34 -9.74 58.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.109 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.3 t -80.76 -8.29 59.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.798 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.076 179.77 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.965 0.412 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -120.0 38.4 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.564 179.199 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 65.2 tt0 -127.81 -56.07 1.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.361 -179.126 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.577 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.2 ptt? -74.91 1.18 13.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -178.816 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.706 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -65.09 -41.52 94.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.672 -179.457 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.022 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.04 26.67 3.39 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.563 -179.119 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -138.98 -4.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.994 0.426 . . . . 0.0 110.895 179.754 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.577 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 4.5 tpm_? -126.99 -24.41 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.987 179.864 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.645 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -74.9 -30.03 61.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.328 179.703 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.482 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.04 -54.67 4.3 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.031 -178.089 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.8 Cg_endo -65.27 -26.28 56.59 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.934 1.756 . . . . 0.0 112.028 178.993 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 53' ' ' LEU . 63.8 mt -81.57 -20.97 38.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.688 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 15.6 mm -69.53 -36.95 73.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.808 0.337 . . . . 0.0 110.112 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.685 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.9 mt-30 -53.41 -14.78 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 178.049 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.71 -40.42 20.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.698 178.702 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.25 -45.52 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.188 0.518 . . . . 0.0 110.142 179.26 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 9.3 m-70 -112.3 145.51 33.01 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.927 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.508 ' O ' ' HB ' ' A' ' 84' ' ' THR . 18.2 Cg_exo -30.97 -49.08 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.26 2.64 . . . . 0.0 112.456 -179.354 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.685 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 11.6 t 173.85 22.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.938 178.567 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -72.24 11.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.566 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.468 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -77.03 44.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.477 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -85.69 -10.7 75.77 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.332 177.979 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 88' ' ' LYS . 1.5 tptt -175.11 31.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.245 179.414 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.815 HG21 HG13 ' A' ' 115' ' ' VAL . 62.1 mt -79.58 -89.35 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 120.806 -0.357 . . . . 0.0 110.561 179.119 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.022 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.54 -38.57 60.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 179.241 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.47 -31.91 57.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.993 178.01 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.744 ' HG2' HG22 ' A' ' 96' ' ' ILE . 38.4 ttp -83.37 -23.14 32.57 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.717 -0.241 . . . . 0.0 110.446 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 90' ' ' THR . 4.6 mm? -61.92 -6.18 2.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.497 178.68 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.706 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.99 20.84 17.96 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 176.476 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.673 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -162.52 1.72 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.473 -179.327 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.96 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.06 -152.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 121.35 0.595 . . . . 0.0 111.757 -179.9 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.549 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.4 t70 -59.43 -2.2 0.3 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.262 178.256 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.584 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.3 m-80 78.55 -31.16 0.15 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.53 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -73.1 -29.54 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.02 0.438 . . . . 0.0 109.924 178.353 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.96 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -78.28 -21.84 49.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.757 177.533 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.65 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.8 tp -75.25 -25.01 57.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.902 176.999 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.2 mp -90.63 -46.34 8.34 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.286 -179.127 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -37.78 88.74 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.116 -178.926 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.835 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -60.86 -36.67 79.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.55 -179.657 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.6 mt -87.38 -6.03 58.63 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 110.518 179.639 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 58.8 mm-40 -109.5 -13.48 14.56 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.642 -175.701 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -138.3 139.11 24.26 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -176.825 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 8.2 Cg_exo -74.24 19.55 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 112.366 179.571 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.77 -26.14 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.99 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 107' ' ' SER . 0.6 OUTLIER -62.92 -41.25 99.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.58 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.902 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.08 -28.1 1.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.964 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -96.24 -65.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.076 -179.718 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 31.9 t -46.95 -29.28 1.96 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.374 . . . . 0.0 110.262 179.368 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 39.3 mmtt -80.69 -42.34 22.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.723 177.784 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.815 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -64.79 -60.07 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.154 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -49.34 -40.64 36.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.864 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.56 -33.87 64.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.908 0.385 . . . . 0.0 110.338 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.442 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.14 -21.66 64.91 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.975 178.24 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.722 HG22 HD13 ' A' ' 89' ' ' ILE . 24.2 t -67.83 -46.15 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.738 176.813 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.45 -32.08 72.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.575 177.283 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 12.2 t -79.41 -30.81 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.614 179.166 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.627 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -74.69 -42.02 59.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.29 179.904 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.405 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.6 mm100 -61.18 -30.66 70.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.707 178.546 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.467 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.435 177.354 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.589 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.736 0.303 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -169.59 -178.72 3.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.144 178.329 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.985 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.3 -33.68 29.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.7 -47.97 65.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.793 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.554 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.09 -37.82 75.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.491 0.662 . . . . 0.0 109.749 178.431 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.985 HD12 ' HA ' ' A' ' 55' ' ' ALA . 15.7 mt -66.08 -44.15 85.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.638 179.239 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.37 -9.67 35.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.562 178.803 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 57' ' ' MET . 40.1 m -78.94 -5.8 54.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.955 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.455 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.423 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.915 -179.291 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.567 ' C ' HD11 ' A' ' 70' ' ' LEU . 2.3 mt-30 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.974 0.416 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.688 ' C ' HD21 ' A' ' 70' ' ' LEU . 4.8 ptmt -134.67 27.88 3.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.734 179.314 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -135.09 -49.43 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.916 -179.867 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.438 ' HE1' ' O ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -80.77 3.2 23.14 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -176.863 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.851 HD23 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -75.38 -35.31 61.1 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.107 0.48 . . . . 0.0 109.862 179.375 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.081 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.1 26.99 4.36 Favored Glycine 0 N--CA 1.438 -1.219 0 C-N-CA 119.847 -1.168 . . . . 0.0 112.702 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -144.34 -1.25 0.94 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.763 0.316 . . . . 0.0 111.381 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.0 -22.09 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.313 0.578 . . . . 0.0 109.972 179.118 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.699 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.09 -23.82 47.8 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.499 178.649 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.453 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -36.74 -54.63 1.67 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.438 -178.176 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.4 Cg_endo -72.1 -22.05 23.13 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.034 1.823 . . . . 0.0 112.795 -179.334 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.589 HD12 ' HB2' ' A' ' 53' ' ' LEU . 94.3 mt -89.36 -19.06 25.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.888 -178.73 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.802 HG13 ' HB ' ' A' ' 90' ' ' THR . 9.8 mm -73.79 -40.11 53.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 178.086 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.0 OUTLIER -53.89 -17.09 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.858 177.351 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.49 -37.88 35.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.868 178.732 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.702 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.25 -47.14 52.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.485 179.973 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.0 m-70 -113.33 148.97 40.74 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.622 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -56.3 79.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.433 2.088 . . . . 0.0 111.981 179.284 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.504 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 58.4 p 45.57 34.42 1.67 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.154 -178.483 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -89.7 6.95 39.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.016 -179.73 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -80.1 46.92 0.85 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.272 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.52 85.7 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.562 -0.828 . . . . 0.0 111.583 178.315 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.705 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -174.3 29.07 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.92 0.39 . . . . 0.0 110.702 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.933 HG21 HG13 ' A' ' 115' ' ' VAL . 65.8 mt -80.43 -93.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.406 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.081 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -50.67 -40.77 54.54 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.444 -178.925 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.08 -31.51 56.12 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.092 -1.051 . . . . 0.0 111.054 178.686 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.695 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.99 -22.75 28.98 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 120.846 0.355 . . . . 0.0 110.155 179.412 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.554 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.89 -5.78 2.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.851 HD11 HD23 ' A' ' 70' ' ' LEU . 5.1 mp -108.51 26.7 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.166 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.604 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.3 pt-20 -165.93 -0.21 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.314 -179.267 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.93 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.04 -152.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.366 0.603 . . . . 0.0 111.517 -179.993 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.5 t70 -59.44 -3.84 0.5 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.307 177.941 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.606 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.9 m-20 77.61 -28.73 0.17 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.356 -179.576 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -74.03 -26.55 60.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.93 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.4 OUTLIER -81.33 -26.49 35.57 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.454 176.985 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -74.96 -25.26 58.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.403 176.242 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.73 -48.43 8.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.214 -179.374 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.554 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -62.76 -42.32 99.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.091 -178.863 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.757 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.49 -33.63 66.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.303 -179.726 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.721 HD23 HD13 ' A' ' 58' ' ' LEU . 25.9 mt -86.76 -10.3 53.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.054 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.72 -8.92 15.29 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.735 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -140.72 133.38 14.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.846 -178.723 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.517 ' O ' HG21 ' A' ' 54' ' ' THR . 60.3 Cg_endo -71.4 3.71 3.41 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.595 2.196 . . . . 0.0 111.803 178.846 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -126.47 -11.09 6.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -79.06 -46.07 18.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.121 0.486 . . . . 0.0 109.704 177.989 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.54 -40.47 18.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.205 176.097 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 113' ' ' SER . 3.8 ttt180 -80.33 -57.33 3.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.375 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.417 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 42.1 t -53.71 -56.83 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.766 0.317 . . . . 0.0 110.799 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 7.6 mmtm -54.65 -32.81 59.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.933 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -72.11 -58.32 5.34 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.046 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.31 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -31.47 58.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.113 0.482 . . . . 0.0 110.29 178.552 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -79.95 -32.45 39.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.832 178.408 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.695 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.69 -20.81 63.55 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.746 177.468 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.702 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.5 t -69.48 -47.8 70.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.412 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.3 -25.58 64.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.471 177.03 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 6.2 t -86.05 -34.96 8.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.098 178.692 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.705 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -67.23 -33.3 75.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.203 178.254 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.58 -27.34 37.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.615 176.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.368 179.295 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.775 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.65 0.262 . . . . 0.0 110.976 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.861 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.98 -175.36 1.21 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.647 178.585 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.49 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.34 -45.77 55.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.591 -179.687 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.7 m -55.9 -45.45 78.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.8 0.333 . . . . 0.0 110.718 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.495 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -60.29 -42.91 96.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.377 178.964 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.68 -46.9 86.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.338 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.46 -9.48 53.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.026 179.65 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.2 t -82.22 -9.17 59.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.003 -179.615 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.419 179.878 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.717 0.294 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.629 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -127.15 26.33 6.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.032 179.686 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.489 ' N ' HD21 ' A' ' 70' ' ' LEU . 2.6 tt0 -128.34 -53.28 1.28 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.937 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.42 ' HB2' ' CB ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -78.58 20.5 0.43 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.155 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.822 HD13 HD21 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -89.65 -53.43 4.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.168 0.508 . . . . 0.0 110.385 179.698 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.074 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -108.32 18.66 32.85 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.379 -0.915 . . . . 0.0 111.775 178.977 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.78 -10.59 2.07 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.338 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.549 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.55 -15.38 5.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.571 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.726 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -78.13 -12.67 60.01 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.526 179.968 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.4 t80 -49.64 -54.55 30.13 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.768 -177.995 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 26.3 Cg_exo -63.27 -7.88 13.16 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.139 1.892 . . . . 0.0 112.329 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.775 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.1 mm? -98.63 -37.46 9.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.65 -179.178 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.597 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.5 mm -61.1 -42.46 93.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-O 120.717 0.294 . . . . 0.0 110.942 -179.626 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.8 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -48.88 -18.79 0.31 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.956 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.49 -40.14 18.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.255 179.378 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.479 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.53 -35.47 68.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.347 0.594 . . . . 0.0 110.601 179.674 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.706 ' CE1' HG21 ' A' ' 119' ' ' VAL . 7.2 m170 -121.61 157.44 56.75 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.649 -177.037 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.501 ' HD2' HD13 ' A' ' 85' ' ' LEU . 16.3 Cg_exo -67.29 69.08 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.488 2.126 . . . . 0.0 111.586 179.031 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.8 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.5 OUTLIER 52.41 24.2 2.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.753 -178.252 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.501 HD13 ' HD2' ' A' ' 83' ' ' PRO . 0.0 OUTLIER -76.93 1.97 16.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.168 -179.33 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.39 -135.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.232 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.76 -17.24 11.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.97 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.953 ' HE2' ' HB2' ' A' ' 122' ' ' LEU . 0.1 OUTLIER -155.88 -20.98 0.11 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.846 HG21 HG13 ' A' ' 115' ' ' VAL . 61.2 mt -50.17 -80.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 CA-C-N 117.706 0.23 . . . . 0.0 111.397 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.074 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.1 -40.22 67.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.557 0.217 . . . . 0.0 110.88 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.95 -28.77 61.22 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.581 176.836 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.645 ' HE3' ' HB1' ' A' ' 118' ' ' ALA . 3.3 ttm -75.65 -37.0 60.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 121.474 0.654 . . . . 0.0 109.83 177.35 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.717 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.06 -9.63 0.66 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.72 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.611 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.24 27.09 8.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.363 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.8 pt-20 -170.19 1.26 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.758 -178.477 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.982 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.99 -148.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 121.436 0.636 . . . . 0.0 111.42 -179.768 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 3.3 t70 -54.38 -9.82 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.799 175.929 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.702 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.6 m120 79.43 -24.1 0.22 Allowed 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.41 -0.813 . . . . 0.0 111.164 -179.696 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -75.51 -28.47 59.15 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.564 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.982 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.42 -33.91 63.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.007 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.3 -27.73 68.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.194 178.445 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.602 HD12 HD23 ' A' ' 101' ' ' LEU . 2.7 mp -85.58 -48.33 9.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -39.06 90.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.501 -178.527 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.866 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -57.45 -37.49 72.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.37 -179.365 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.822 HD21 HD13 ' A' ' 70' ' ' LEU . 6.6 mt -87.5 -8.52 56.31 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.115 0.483 . . . . 0.0 110.293 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -106.47 -8.4 17.12 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.267 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.791 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.95 133.48 11.61 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.63 0.252 . . . . 0.0 111.557 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.499 ' O ' HG21 ' A' ' 54' ' ' THR . 51.2 Cg_endo -69.29 3.44 2.54 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.692 2.261 . . . . 0.0 112.207 179.46 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.17 -26.0 3.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.23 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.76 -44.1 94.44 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.223 179.743 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.866 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -47.43 -41.24 19.8 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.471 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 112' ' ' ARG . 1.6 ttt180 -79.09 -64.15 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 t -49.18 -54.07 18.2 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.717 0.294 . . . . 0.0 111.134 -178.901 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.427 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 5.4 mmtt -59.38 -28.95 67.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.091 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.846 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -71.85 -58.41 5.17 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 178.142 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.433 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.8 t70 -51.24 -36.69 43.09 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.864 0.364 . . . . 0.0 110.869 178.089 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.74 -40.17 69.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.477 179.015 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.645 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.39 -29.82 70.76 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.931 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.706 HG21 ' CE1' ' A' ' 82' ' ' HIS . 22.4 t -55.49 -50.62 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-O 121.387 0.613 . . . . 0.0 109.822 177.387 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.51 -29.16 34.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.763 177.442 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.446 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 12.3 t -84.6 -31.65 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.898 179.13 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.953 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.36 -43.17 74.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.958 179.503 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.503 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.3 mm-40 -65.37 -30.33 71.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.887 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.315 179.026 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.671 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.711 0.291 . . . . 0.0 111.121 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.869 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.42 -178.2 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.325 178.026 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.939 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.19 -38.39 39.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.645 -179.134 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.1 -48.91 74.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.843 -179.953 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.561 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.13 -40.23 80.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.296 0.569 . . . . 0.0 110.357 179.377 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.939 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.3 mt -64.08 -45.0 90.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.98 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.82 -7.66 29.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.567 178.792 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.444 ' HB3' ' O ' ' A' ' 57' ' ' MET . 21.5 t -83.77 -5.23 59.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.768 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.353 -179.493 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.606 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.117 0.484 . . . . 0.0 110.297 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.729 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -129.92 40.21 3.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.407 179.3 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.418 ' N ' HD21 ' A' ' 70' ' ' LEU . 52.0 tt0 -138.01 -52.71 0.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.972 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.529 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 3.7 ptt? -81.7 6.52 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -176.942 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 1.034 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -63.05 -59.08 5.28 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.257 0.551 . . . . 0.0 110.2 -179.82 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.011 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -116.91 32.53 5.44 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.201 -1.0 . . . . 0.0 112.697 -179.183 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -141.09 -1.06 1.4 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.733 0.301 . . . . 0.0 111.27 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.26 -23.04 3.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.092 0.472 . . . . 0.0 110.057 179.343 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.708 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.5 -22.42 54.5 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.663 178.62 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -40.09 -55.26 4.02 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.241 -177.952 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 59.5 Cg_endo -72.4 -16.04 27.8 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.04 1.826 . . . . 0.0 112.596 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.671 HD12 ' HB2' ' A' ' 53' ' ' LEU . 50.6 mt -92.84 -21.1 20.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.603 -179.136 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.74 HG13 ' HB ' ' A' ' 90' ' ' THR . 10.3 mm -73.15 -38.94 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.743 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 0.2 OUTLIER -52.08 -17.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.04 177.724 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -78.17 -39.38 41.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.864 178.663 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.689 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -71.42 -45.01 63.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.538 -179.96 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 5.4 m-70 -115.45 139.95 25.28 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.382 -179.979 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -50.5 82.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.53 2.154 . . . . 0.0 112.147 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.743 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 73.5 p 43.72 40.04 2.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.163 -178.837 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -97.17 6.28 48.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.183 -179.477 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -81.07 56.31 2.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.106 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.91 -8.56 75.83 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.151 177.805 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.634 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.2 tptt -177.65 31.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.394 179.737 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.882 HG21 HG13 ' A' ' 115' ' ' VAL . 80.9 mt -79.66 -89.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.981 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.011 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -51.66 -42.46 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.448 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.47 -30.65 50.32 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.014 -1.089 . . . . 0.0 110.919 178.665 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.638 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -83.8 -23.58 31.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.452 -0.374 . . . . 0.0 110.199 178.941 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.57 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.2 mm? -60.72 -10.61 5.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.91 179.052 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.034 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.5 mp -105.68 27.17 8.7 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 176.755 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.638 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -166.03 -0.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.699 -178.993 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 1.016 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.44 -150.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.508 0.67 . . . . 0.0 111.727 -179.389 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.606 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -55.09 -8.43 0.28 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.851 175.896 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.764 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 80.08 -31.13 0.13 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.942 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.94 -29.17 68.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.834 178.44 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 1.016 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -76.08 -34.96 59.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.757 177.255 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.752 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -64.62 -30.15 71.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.913 178.263 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.67 -47.75 11.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.362 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.0 OUTLIER -64.79 -42.2 95.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.494 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.75 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.17 -34.9 66.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.505 -179.123 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.677 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.8 mt -85.84 -11.04 54.39 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.937 -179.544 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 1.5 pt-20 -109.53 -4.83 15.99 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.113 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -143.56 133.52 11.92 Favored Pre-proline 0 C--N 1.331 -0.207 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.948 -179.245 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 54' ' ' THR . 12.8 Cg_exo -70.73 1.13 5.38 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.98 2.453 . . . . 0.0 111.946 179.316 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.551 ' O ' ' HB2' ' A' ' 113' ' ' SER . 76.7 mt-10 -125.56 -11.48 6.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.537 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.04 -44.98 24.88 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.142 0.496 . . . . 0.0 109.733 177.908 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.869 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.77 -41.92 24.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.25 176.07 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.66 -61.14 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.551 -179.499 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.551 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.96 -53.23 20.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.809 0.338 . . . . 0.0 111.224 -178.895 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.68 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 71.4 mmtt -60.59 -29.74 69.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.018 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.882 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.81 -56.01 11.65 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.253 178.774 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.428 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -53.88 -35.36 61.49 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 110.512 178.761 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -38.88 63.29 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.28 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.36 -22.56 66.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.759 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.1 t -68.37 -49.01 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-O 121.084 0.469 . . . . 0.0 109.831 177.022 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.46 -27.17 65.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.389 177.149 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.5 t -83.88 -30.8 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.464 179.097 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -76.07 -33.52 59.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.824 178.804 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -67.54 -33.43 75.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.862 178.442 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.549 177.8 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.816 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.775 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -167.83 179.37 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.372 179.521 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.625 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -46.5 -44.51 17.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.664 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -46.64 82.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.729 179.921 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.509 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.09 -42.36 85.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.898 178.565 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.556 HD22 ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -61.12 -42.23 98.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.417 178.583 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -17.29 48.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.507 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.9 t -69.7 -22.05 63.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.117 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.838 -179.874 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 120.946 0.403 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.558 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -126.85 31.01 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 -179.607 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.516 ' N ' HD21 ' A' ' 70' ' ' LEU . 30.2 tt0 -132.46 -55.93 0.96 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.712 -179.523 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.734 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 2.8 ptt? -80.9 28.12 0.36 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.563 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -89.87 -47.38 7.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.24 0.543 . . . . 0.0 109.956 178.834 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -110.79 12.62 29.78 Favored Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 177.658 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -127.51 0.53 6.24 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.466 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.734 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.49 -31.56 2.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.787 -0.188 . . . . 0.0 111.325 -179.706 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.849 HD22 HD12 ' A' ' 53' ' ' LEU . 2.9 mm? -57.62 -27.15 62.52 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.127 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' CD ' ' A' ' 76' ' ' PRO . 9.2 t80 -38.41 -62.12 0.75 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.003 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.656 ' HG2' HD22 ' A' ' 77' ' ' LEU . 30.0 Cg_endo -62.19 -14.81 40.29 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.897 1.731 . . . . 0.0 112.312 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.656 HD22 ' HG2' ' A' ' 76' ' ' PRO . 2.1 mm? -96.73 -25.99 15.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.866 -178.685 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' A' ' 74' ' ' LEU . 7.3 mm -70.88 -46.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 CA-C-O 120.845 0.355 . . . . 0.0 110.758 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.944 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 21.4 mt-30 -50.11 -19.22 0.7 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.543 178.876 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.61 -37.71 27.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.961 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.5 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.87 -37.27 62.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.757 -179.838 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -124.49 150.62 65.19 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.605 -179.526 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.27 79.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.438 2.092 . . . . 0.0 111.641 179.036 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.944 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 13.1 t 40.35 36.62 0.36 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.368 -178.3 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -86.13 2.63 45.99 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.072 -179.87 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.588 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.75 -141.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.403 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.66 -7.16 59.22 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.816 -179.132 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.656 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.8 OUTLIER -161.98 -25.24 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.748 -0.226 . . . . 0.0 111.527 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.764 HG21 HG13 ' A' ' 115' ' ' VAL . 61.8 mt -49.14 -81.97 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -178.39 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.74 -37.21 70.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.821 -179.828 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.72 -28.33 56.69 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 177.032 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.583 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.23 -34.67 55.93 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.33 0.586 . . . . 0.0 109.797 177.17 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.726 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -58.27 -9.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.591 -178.264 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.476 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.5 mm? -104.31 26.75 8.51 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.751 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -171.36 1.03 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.031 -178.274 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.999 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.66 -148.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.466 0.651 . . . . 0.0 111.696 -179.239 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.605 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.6 t0 -54.24 -9.67 0.3 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.863 176.167 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.691 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.7 m120 79.66 -22.07 0.3 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -78.29 -25.33 46.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.058 0.456 . . . . 0.0 109.791 177.407 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.999 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -78.72 -25.44 44.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.817 177.327 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.702 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.9 tp -74.66 -27.24 60.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.094 178.491 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.48 -45.67 9.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.829 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.408 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.7 t-80 -62.85 -47.03 85.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.166 -178.92 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.877 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.1 ptm -52.59 -35.71 54.74 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.536 -178.779 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.73 HD21 HD13 ' A' ' 70' ' ' LEU . 25.1 mt -83.57 -11.92 56.75 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.963 -178.695 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -108.33 -11.56 15.18 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.715 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.478 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.15 137.05 17.53 Favored Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.981 -178.941 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 6.5 Cg_exo -73.63 2.22 6.07 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.941 2.427 . . . . 0.0 111.923 179.433 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -121.42 -16.01 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.546 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.478 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 3.3 p -74.66 -51.22 14.98 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.007 0.432 . . . . 0.0 109.859 178.612 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.877 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.1 OUTLIER -46.78 -38.77 10.61 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.319 177.429 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.412 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 16.1 ttt180 -81.05 -65.42 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.242 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.411 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 74.9 m -47.63 -54.5 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.785 0.326 . . . . 0.0 111.22 -178.936 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.428 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 9.0 mmtt -58.89 -33.06 70.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.132 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.764 HG13 HG21 ' A' ' 89' ' ' ILE . 1.3 t -70.61 -55.03 15.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -40.1 60.63 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.89 178.174 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -73.58 -34.9 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.24 178.936 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 121' ' ' VAL . . . -66.6 -24.15 66.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.961 178.016 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -63.5 -51.46 70.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 176.61 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.6 -24.67 34.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.538 176.997 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 34.7 t -84.63 -32.83 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.924 179.489 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.656 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.71 -44.23 62.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.023 179.294 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.551 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.0 mm-40 -63.73 -29.5 70.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.986 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.495 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.949 178.276 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.826 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.847 0.356 . . . . 0.0 110.963 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.571 HG21 ' O ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -168.36 -167.16 0.77 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.106 178.658 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 1.079 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.75 -34.5 65.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.51 -178.894 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 75.2 m -65.0 -51.54 61.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.646 179.569 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.658 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.1 -38.23 76.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.278 179.219 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.079 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.2 mt -63.03 -44.64 95.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.575 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.0 -15.99 38.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.96 179.736 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 t -72.76 -5.95 41.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 179.562 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.088 179.891 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.946 0.403 . . . . 0.0 111.146 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.666 ' CA ' HD21 ' A' ' 70' ' ' LEU . 1.8 mttt -136.62 11.16 3.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.291 178.915 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -120.39 -56.55 1.97 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.681 -179.193 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.466 ' HB3' ' HB2' ' A' ' 73' ' ' ARG . 42.8 mtm -60.82 -7.92 2.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -177.572 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.666 HD21 ' CA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -64.73 -48.76 73.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.124 0.488 . . . . 0.0 110.204 -179.124 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.121 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -117.85 14.39 12.76 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.732 178.488 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -128.01 1.58 5.92 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.691 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.53 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.6 tpt180 -126.38 -34.6 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.244 -0.183 . . . . 0.0 110.897 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.758 ' HB3' HD11 ' A' ' 78' ' ' ILE . 3.0 mm? -59.14 -35.25 73.17 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 178.807 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.504 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.0 t80 -35.19 -61.68 0.48 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -174.533 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 33.8 Cg_endo -63.87 -16.86 57.27 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.057 1.838 . . . . 0.0 112.528 -178.972 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.826 HD12 ' HB2' ' A' ' 53' ' ' LEU . 52.4 mt -98.53 -23.95 15.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.799 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.758 HD11 ' HB3' ' A' ' 74' ' ' LEU . 1.6 mm -69.18 -35.78 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-O 120.97 0.414 . . . . 0.0 110.214 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.78 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.1 mt-30 -53.29 -17.32 1.71 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.26 -38.83 20.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.832 178.941 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.2 -44.85 67.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.126 0.489 . . . . 0.0 110.436 179.549 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -115.75 155.03 48.09 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.227 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.23 75.56 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.47 2.113 . . . . 0.0 111.994 179.538 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.78 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 30.3 p 47.17 45.85 16.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.213 -179.318 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 2.4 mp -103.39 9.09 38.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.073 -179.636 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -71.39 20.95 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.973 -179.219 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -48.64 -27.35 6.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 178.805 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 92' ' ' MET . 5.0 ttpt -171.9 40.41 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.154 178.823 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.778 HG21 HG13 ' A' ' 115' ' ' VAL . 47.8 mt -79.84 -83.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.649 178.684 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.121 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.5 -35.9 63.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.418 179.01 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.02 -30.2 60.19 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.219 -1.153 . . . . 0.0 110.219 176.38 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.586 ' HE1' ' O ' ' A' ' 118' ' ' ALA . 3.2 ttp -75.14 -36.11 61.61 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.031 -0.585 . . . . 0.0 109.882 176.451 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.9 -3.7 0.59 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.582 -177.656 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 101' ' ' LEU . 4.0 mp -109.2 26.16 10.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 175.669 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -170.86 3.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.34 -178.384 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.82 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.4 -150.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 121.483 0.659 . . . . 0.0 111.619 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.6 t70 -59.58 -2.76 0.38 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.108 177.356 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.634 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.2 m120 77.99 -31.56 0.16 Allowed 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.208 -179.651 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.98 78.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.297 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.82 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.5 mt-10 -68.18 -43.91 77.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.367 177.388 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.731 HD23 HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -54.76 -21.83 12.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.804 0.335 . . . . 0.0 110.711 177.316 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.731 HD12 HD23 ' A' ' 101' ' ' LEU . 2.5 mp -92.92 -45.12 8.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.735 -179.197 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.1 OUTLIER -70.24 -30.25 67.27 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.708 -177.839 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.76 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 0.5 OUTLIER -65.19 -34.51 78.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.632 0.253 . . . . 0.0 110.78 179.846 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.747 HD23 HD13 ' A' ' 58' ' ' LEU . 5.7 mt -87.13 -12.14 47.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.167 0.508 . . . . 0.0 110.052 178.266 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 21.5 mm-40 -105.69 -4.72 20.67 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.083 -176.16 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.909 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.2 t -149.03 133.14 8.76 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.555 -179.415 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.571 ' O ' HG21 ' A' ' 54' ' ' THR . 74.4 Cg_endo -74.55 8.93 2.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.586 2.191 . . . . 0.0 112.358 179.723 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -133.89 -20.51 1.97 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.11 -179.882 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.909 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.2 OUTLIER -64.55 -53.31 49.98 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.208 0.528 . . . . 0.0 109.784 177.73 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 10.0 tt -47.64 -35.36 9.25 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.175 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -86.63 -52.1 5.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.1 m -52.7 -50.13 63.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.663 -178.019 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.76 ' NZ ' ' HB3' ' A' ' 104' ' ' MET . 0.4 OUTLIER -80.4 -25.65 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.946 -178.533 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.778 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -59.9 -51.34 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.594 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.23 -34.42 70.42 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.434 177.467 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -77.18 -27.34 53.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.719 178.331 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.586 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -71.98 -27.74 62.96 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.224 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 16.4 t -58.2 -51.35 72.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.752 176.01 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.53 -28.53 31.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.797 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.52 -31.03 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.99 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.473 HD22 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -69.57 -41.75 75.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.9 179.094 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 82.4 mm-40 -72.49 -24.43 61.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.224 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.189 179.427 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.784 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 110.59 -0.152 . . . . 0.0 110.59 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.81 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -166.86 -176.35 3.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.144 0.497 . . . . 0.0 111.999 179.553 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.08 -56.91 12.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.393 -0.822 . . . . 0.0 112.686 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.2 m -47.37 -34.36 6.89 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.105 0.478 . . . . 0.0 110.97 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.674 ' SD ' ' HA ' ' A' ' 53' ' ' LEU . 4.3 mtt -75.35 -41.54 56.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.447 179.141 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -55.98 -38.09 69.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.822 176.859 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.22 -23.66 62.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.428 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -68.15 -7.39 29.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.29 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.259 -179.742 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.903 0.382 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.611 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.4 28.99 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.966 -179.822 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.429 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -134.08 -52.02 0.84 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.194 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.474 ' HB2' ' CB ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -78.48 15.89 0.92 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -177.175 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.43 -31.72 17.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.115 0.483 . . . . 0.0 110.591 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.024 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.36 10.39 5.31 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.552 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -127.92 -6.17 5.59 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.583 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -126.54 -16.51 5.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.935 0.397 . . . . 0.0 110.565 179.354 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.784 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.72 -16.75 58.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.059 178.964 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.725 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 13.8 t80 -49.34 -53.88 35.48 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.924 -177.543 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.1 Cg_exo -65.73 -6.45 14.0 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.149 1.9 . . . . 0.0 112.494 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.608 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.78 -38.68 8.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.635 -179.274 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.783 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.8 mm -60.0 -40.47 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.883 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.904 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 31.0 mt-30 -47.66 -21.45 0.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.796 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.11 -44.03 17.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.848 178.904 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -66.78 -43.14 84.75 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.302 0.572 . . . . 0.0 110.225 179.187 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.871 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.7 m170 -121.52 143.99 39.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.456 -177.729 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.53 80.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.563 2.175 . . . . 0.0 112.254 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.904 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 61.9 p 43.32 32.72 0.51 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.196 -179.115 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -88.34 6.93 34.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.09 -179.367 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.783 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.59 20.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.882 -179.422 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -54.26 -22.62 22.88 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.834 -179.933 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.0 OUTLIER -165.46 28.76 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.0 111.216 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.866 HG21 HG13 ' A' ' 115' ' ' VAL . 60.8 mt -80.42 -88.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.386 -0.525 . . . . 0.0 110.817 179.019 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.024 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.02 -41.5 59.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.279 -179.943 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.67 -31.13 57.48 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.068 -1.063 . . . . 0.0 111.055 178.497 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.63 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.43 -23.29 32.37 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 178.685 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.628 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.63 -7.53 3.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.631 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.666 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.6 mp -106.66 26.26 10.2 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.7 pt-20 -167.08 1.87 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.33 -178.608 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.948 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -151.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 121.334 0.587 . . . . 0.0 111.697 -179.702 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 0.8 OUTLIER -59.04 -3.56 0.37 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.998 177.949 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 34.3 m-80 79.19 -28.65 0.15 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.524 179.536 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -31.22 60.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.09 0.471 . . . . 0.0 109.877 178.201 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.948 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -75.42 -23.32 56.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.937 177.863 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -75.1 -25.62 58.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.862 177.031 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mp -87.15 -49.38 7.33 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.984 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.49 -46.97 87.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.709 -179.548 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.924 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -53.2 -36.51 61.05 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -178.169 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' HD23 ' A' ' 58' ' ' LEU . 6.9 mt -86.64 -5.5 59.11 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.342 0.592 . . . . 0.0 110.071 179.1 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -110.44 -8.09 14.71 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.001 -175.026 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.476 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.4 OUTLIER -146.25 142.0 17.09 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.061 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.507 ' O ' HG21 ' A' ' 54' ' ' THR . 7.5 Cg_exo -73.2 -0.57 9.34 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 179.437 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -124.43 -19.38 5.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.568 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 4.4 p -63.74 -50.53 68.71 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.233 0.54 . . . . 0.0 109.79 178.169 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.924 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -46.49 -29.24 1.67 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.118 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.59 -63.42 1.23 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.985 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 43.5 m -49.31 -30.21 7.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.958 179.15 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.0 mmtm -80.84 -41.22 23.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.844 178.093 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.866 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -66.43 -62.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.124 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t0 -48.67 -36.13 15.37 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.644 0.259 . . . . 0.0 111.258 178.608 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 113' ' ' SER . 7.4 mt-10 -74.05 -41.14 62.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.818 0.342 . . . . 0.0 110.514 179.114 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.44 -21.77 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.691 178.057 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.871 HG21 ' CE1' ' A' ' 82' ' ' HIS . 59.1 t -66.79 -46.43 85.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.866 177.412 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.16 -26.57 66.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.506 176.652 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 11.2 t -85.32 -32.08 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.579 179.057 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.503 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.79 -35.77 70.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.825 179.004 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -71.97 -28.52 63.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.114 178.33 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.235 179.234 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.825 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.845 0.355 . . . . 0.0 110.95 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.904 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -163.62 -171.95 2.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.489 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.73 -36.88 62.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.192 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.95 -46.01 92.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.064 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.825 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.66 -43.22 89.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.056 178.325 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.532 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -57.77 -48.23 80.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.572 178.973 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.37 -3.21 19.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.367 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 t -87.23 -6.77 58.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.074 -179.787 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.283 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.675 -179.954 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.953 0.406 . . . . 0.0 110.648 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.651 ' HA ' HD21 ' A' ' 70' ' ' LEU . 5.4 ptpt -116.18 40.65 2.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.888 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -139.23 -54.54 0.58 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.721 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.614 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -81.08 3.07 24.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.849 -178.889 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.816 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -69.97 -39.33 76.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 0.0 111.085 179.765 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.082 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.34 24.96 3.34 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.236 -0.983 . . . . 0.0 112.87 -179.504 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -138.09 -5.42 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.582 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.28 -20.85 4.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.873 -179.825 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.744 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -74.83 -13.09 60.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.692 -178.748 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.719 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 8.4 t80 -48.32 -56.71 13.06 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.703 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.719 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 24.5 Cg_exo -63.29 -11.7 26.77 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.042 1.828 . . . . 0.0 112.046 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.1 mm? -94.79 -28.35 15.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.462 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.763 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -67.78 -39.64 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.013 -179.608 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.881 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -50.47 -20.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 110.125 178.682 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.75 -40.87 24.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.449 179.668 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.763 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.44 -50.75 28.7 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.184 0.516 . . . . 0.0 110.52 -179.62 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.784 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -111.49 151.61 43.39 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.491 -179.673 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.612 ' HG2' HD23 ' A' ' 85' ' ' LEU . 18.8 Cg_endo -59.53 81.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.387 2.058 . . . . 0.0 111.798 179.555 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.881 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.0 t 42.13 31.0 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.532 -178.776 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.654 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -80.45 2.22 26.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.01 -144.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.971 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.72 -15.62 50.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.69 -179.114 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.833 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.1 tptt -156.46 -22.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.953 HG21 HG13 ' A' ' 115' ' ' VAL . 68.4 mt -49.25 -86.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -177.491 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.082 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.97 -41.83 64.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.276 -178.599 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.27 -31.45 50.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.217 178.463 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.833 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.79 -25.06 30.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.885 0.374 . . . . 0.0 110.323 179.185 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.616 HD12 ' HE3' ' A' ' 104' ' ' MET . 4.1 mm? -59.08 -10.86 2.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.417 178.971 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.816 HD21 HD13 ' A' ' 70' ' ' LEU . 3.8 mp -101.89 25.97 8.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.728 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -169.1 1.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.154 -177.614 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.42 -148.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.41 0.624 . . . . 0.0 111.408 -179.417 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.616 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.2 t70 -54.33 -9.42 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.824 176.081 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.719 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 79.88 -23.1 0.25 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.138 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -32.74 58.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.408 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -69.65 -34.64 74.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.049 177.545 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.668 HD21 HD22 ' A' ' 70' ' ' LEU . 2.3 tm? -65.9 -28.73 69.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.274 178.741 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.15 -49.85 9.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.911 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.509 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 1.5 t-80 -58.79 -48.44 81.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.958 -178.888 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.801 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.9 OUTLIER -52.29 -35.5 50.56 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.157 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 101' ' ' LEU . 17.5 mt -84.8 -8.78 58.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 0.0 110.791 -179.404 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.06 -7.33 16.14 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.615 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.467 ' HB3' ' H ' ' A' ' 110' ' ' SER . 0.5 OUTLIER -143.13 140.15 17.53 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 120.506 -0.477 . . . . 0.0 112.042 -179.169 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.563 ' O ' HG21 ' A' ' 54' ' ' THR . 60.1 Cg_endo -72.18 3.8 3.77 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.645 2.23 . . . . 0.0 111.991 179.07 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -128.72 -19.01 3.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.467 ' H ' ' HB3' ' A' ' 107' ' ' SER . 4.9 p -64.22 -49.86 70.29 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.356 0.598 . . . . 0.0 109.675 177.447 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.904 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.95 -26.78 1.07 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.783 178.05 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -95.94 -65.69 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.78 179.311 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 5.0 m -46.12 -30.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.296 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.786 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 69.4 mmtt -80.44 -42.44 22.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.697 177.819 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.953 HG13 HG21 ' A' ' 89' ' ' ILE . 2.2 t -66.06 -60.37 2.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.874 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.404 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t70 -48.0 -38.9 18.14 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.31 178.679 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 113' ' ' SER . 1.9 mt-10 -76.87 -33.27 57.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.271 179.466 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.751 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.55 -26.79 66.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.882 177.958 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.784 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.0 t -61.52 -51.14 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.05 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.58 32.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.779 177.333 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 14.3 t -85.52 -31.35 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.945 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.701 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.53 -41.31 63.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.026 179.363 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.43 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 2.3 mm100 -61.69 -37.96 86.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 178.822 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.352 177.072 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.735 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.78 0.324 . . . . 0.0 110.736 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.886 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.11 -176.44 2.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.294 179.099 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.972 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.23 -25.06 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 111.269 -179.488 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.449 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 40.6 m -74.23 -49.13 24.65 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.741 179.562 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.735 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.11 -39.45 78.69 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.376 0.608 . . . . 0.0 109.997 178.776 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.972 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.3 mt -64.1 -45.04 90.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.418 179.102 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.79 -7.85 18.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.844 179.066 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.4 t -84.05 -7.3 59.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.616 179.317 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.319 179.819 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.051 0.453 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.456 ' C ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -107.85 36.72 2.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.473 178.471 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 1.3 tp-100 -127.6 -52.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.483 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 14.4 mtm -76.03 -6.17 49.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.659 -179.378 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.82 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -63.2 -32.45 73.85 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.172 -179.421 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 1.036 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -148.74 27.48 1.31 Allowed Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.822 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 3.3 mt-10 -142.29 0.39 1.33 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.891 0.377 . . . . 0.0 111.173 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -136.12 -20.84 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.169 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.647 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -73.48 -22.7 60.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.353 178.283 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.538 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -39.82 -56.04 3.34 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.355 -177.906 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 11.6 Cg_exo -73.1 -15.74 25.69 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.326 2.017 . . . . 0.0 112.784 -179.255 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.68 HD12 ' HB2' ' A' ' 53' ' ' LEU . 37.1 mt -91.23 -32.01 15.93 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.624 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 74' ' ' LEU . 2.5 mm -65.19 -37.13 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.089 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.768 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.0 mt-30 -48.92 -16.16 0.12 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.495 177.14 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.429 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -84.27 -44.58 13.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.675 178.186 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.427 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 1.2 mtm -67.67 -27.81 67.16 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.563 0.697 . . . . 0.0 110.18 178.955 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.616 ' CD2' HD11 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -114.29 164.2 16.97 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.739 -177.257 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.498 ' HD2' ' CG ' ' A' ' 82' ' ' HIS . 74.0 Cg_endo -77.11 47.68 2.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.134 1.889 . . . . 0.0 111.368 177.021 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.768 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 66.45 51.05 1.2 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.796 -178.487 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HB3' ' CD2' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -118.94 0.81 11.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.719 179.789 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.556 ' CB ' ' HB ' ' A' ' 78' ' ' ILE . . . -73.46 58.63 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.179 179.455 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -98.24 -0.7 58.3 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.885 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.5 ttpt -156.74 -15.79 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.023 -0.588 . . . . 0.0 111.908 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.958 HG21 HG13 ' A' ' 115' ' ' VAL . 48.5 mt -51.18 -84.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -176.812 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 90' ' ' THR . . . . . 1.036 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -51.46 -38.37 53.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.02 -177.851 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.95 -29.87 68.77 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.99 -1.1 . . . . 0.0 110.367 176.262 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.885 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.4 ttm -75.56 -37.75 59.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.042 176.996 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.577 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.6 mm? -55.61 -8.34 0.37 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.48 -178.896 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.82 HD11 HD13 ' A' ' 70' ' ' LEU . 4.9 mp -106.26 27.94 8.2 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.688 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.407 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -171.98 3.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.462 -178.252 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.934 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.22 -151.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.318 0.58 . . . . 0.0 111.496 -179.86 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.509 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.8 t0 -59.53 -3.54 0.48 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.237 178.253 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.594 ' H ' HG12 ' A' ' 96' ' ' ILE . 27.4 m120 77.82 -27.23 0.17 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.425 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -77.75 -23.35 49.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 177.785 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.934 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.92 -25.87 29.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.676 177.512 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -74.99 -24.75 58.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.393 0.615 . . . . 0.0 109.385 176.134 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -86.73 -48.6 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.074 -0.967 . . . . 0.0 111.158 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.446 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.04 -37.28 83.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.194 -178.695 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.825 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -57.56 -36.82 72.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.136 -179.85 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.714 HD23 HD13 ' A' ' 58' ' ' LEU . 6.9 mt -87.11 -9.77 54.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.211 0.529 . . . . 0.0 110.047 178.445 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 62.8 mm-40 -108.44 -1.98 19.4 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.28 -176.144 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.845 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -150.32 135.95 10.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.764 -179.462 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.528 ' O ' HG21 ' A' ' 54' ' ' THR . 72.5 Cg_endo -74.04 3.98 4.63 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.566 2.177 . . . . 0.0 112.04 179.025 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 113' ' ' SER . 7.7 mt-10 -128.0 -11.41 5.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.607 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.845 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.83 -44.68 22.48 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.606 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.886 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.28 -40.82 17.67 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.95 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -81.16 -64.39 1.2 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.28 179.38 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.01 -51.13 25.24 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 -178.702 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.814 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 30.9 mmtt -61.01 -30.18 70.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.845 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.958 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -72.83 -55.0 14.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.981 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.62 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 0.5 OUTLIER -56.9 -28.65 62.2 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.227 0.537 . . . . 0.0 109.927 177.314 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -80.02 -33.93 38.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.383 177.223 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.736 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.67 -17.87 64.17 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.514 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.62 ' HB ' ' O ' ' A' ' 116' ' ' ASP . 37.1 t -66.77 -52.79 41.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.412 175.864 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.06 -27.49 61.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.968 177.389 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 15.2 t -85.94 -31.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.691 179.123 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -74.14 -29.35 61.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.348 -179.733 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -83.2 -23.59 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.786 177.28 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.054 179.32 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.34 -63.31 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.603 2.202 . . . . 0.0 112.166 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 mt -89.95 -173.13 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.71 56.97 0.67 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.575 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.6 t -104.12 -61.53 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.731 0.301 . . . . 0.0 110.929 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -109.87 -172.18 1.99 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.042 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.34 102.84 2.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -139.75 -25.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 55.37 72.63 0.47 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.159 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.83 117.91 5.09 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.975 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.34 -4.94 15.95 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.451 2.101 . . . . 0.0 112.341 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.16 74.63 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.005 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.4 t -89.7 23.55 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.1 ttt85 -97.6 -52.49 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 p -97.4 163.7 12.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.004 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 11.2 m -88.72 147.62 39.75 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.071 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.75 147.49 40.48 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.58 2.186 . . . . 0.0 112.387 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -74.29 84.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.862 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -73.78 -14.77 61.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 mptt -96.7 88.32 4.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -78.15 92.83 4.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.23 104.02 9.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.251 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.1 135.86 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.958 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -92.11 48.32 2.69 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.583 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 t -90.67 -20.39 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.971 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.6 mtt180 -79.11 171.92 14.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -85.86 113.43 51.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.869 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.97 88.73 1.06 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.452 2.101 . . . . 0.0 112.397 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -78.9 -174.37 3.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.8 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -74.83 -98.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.826 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.7 m170 51.59 31.14 7.3 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.879 0.371 . . . . 0.0 111.138 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.55 41.7 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.995 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -101.73 8.93 41.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -91.9 71.16 5.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.079 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.568 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 1.0 OUTLIER -96.16 -51.49 0.23 Allowed Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.361 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 25.4 Cg_exo -63.59 -174.0 0.2 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.321 2.014 . . . . 0.0 112.185 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.17 128.56 33.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.813 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 p -86.24 124.28 40.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.023 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.9 t -106.64 -0.99 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.866 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.534 ' O ' ' HG2' ' A' ' 42' ' ' GLN . 0.8 OUTLIER -89.63 177.54 6.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 62.42 20.67 12.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.06 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 40' ' ' MET . 7.5 pt20 -156.9 96.2 2.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.948 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.25 171.64 1.68 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.614 2.209 . . . . 0.0 112.224 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -84.72 57.17 4.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.944 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -104.81 93.15 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.146 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -84.25 179.44 7.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 p -96.63 98.92 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.1 0.476 . . . . 0.0 110.991 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -98.37 -31.76 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.871 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.81 -165.11 34.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.556 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -99.07 -178.51 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.692 0.282 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' H ' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -63.79 129.27 93.7 Favored Pre-proline 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.038 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.46 179.03 6.81 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.465 2.11 . . . . 0.0 112.415 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.679 HD12 ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -92.79 138.61 31.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.838 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.689 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -173.98 -163.76 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.514 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.666 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.29 -43.8 88.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.506 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.446 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 31.9 m -56.56 -45.39 81.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.844 0.354 . . . . 0.0 110.487 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.43 -40.43 94.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.666 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -60.98 -45.38 95.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -9.1 52.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.08 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.0 t -82.41 -8.73 59.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.591 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.73 57.7 27.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.169 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.652 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 52.7 Cg_exo -54.6 -51.53 10.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.392 2.062 . . . . 0.0 113.127 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 61.7 Cg_endo -94.37 15.69 1.18 Allowed 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.424 2.083 . . . . 0.0 112.5 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.458 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 1.9 mt-30 -124.7 -98.84 0.42 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.559 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.762 ' HB2' ' HG3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.07 47.39 0.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.492 -178.075 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.652 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -68.24 -24.73 64.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.053 0.454 . . . . 0.0 110.772 179.23 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.577 ' CA ' HD21 ' A' ' 70' ' ' LEU . 4.7 mmtt -124.79 35.17 4.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.577 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.724 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 6.5 tt0 -130.42 -61.97 0.94 Allowed 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.762 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 35.9 mtm -58.82 -9.38 1.76 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.712 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -70.12 -28.31 65.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.961 0.41 . . . . 0.0 110.81 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.046 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -146.52 9.92 1.45 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.442 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.28 -9.62 6.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.538 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.16 -12.73 5.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.909 0.385 . . . . 0.0 110.531 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.679 ' HG ' HD12 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.59 -17.1 58.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.928 -179.313 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.704 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.7 t80 -47.12 -54.57 19.93 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 22.1 Cg_exo -65.37 -9.25 21.48 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.134 1.889 . . . . 0.0 112.249 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.3 mm? -96.3 -39.06 9.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.794 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.675 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.0 mm -60.34 -41.61 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.859 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.674 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.4 mt-30 -48.53 -20.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.627 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.72 -43.67 16.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.856 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.466 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -67.78 -40.85 83.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.5 179.604 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.846 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.9 m170 -123.18 144.1 42.65 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.55 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -55.75 81.57 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.478 2.119 . . . . 0.0 111.715 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.674 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 9.4 t 41.42 30.3 0.13 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.276 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.56 0.4 34.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.675 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.67 -138.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.621 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.88 -8.56 49.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.856 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.573 ' HE2' ' SD ' ' A' ' 92' ' ' MET . 1.2 tptt -161.3 -25.6 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.738 -0.231 . . . . 0.0 111.501 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.81 HG21 HG13 ' A' ' 115' ' ' VAL . 61.0 mt -49.2 -80.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.046 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.63 -38.51 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.684 -0.235 . . . . 0.0 110.937 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.79 -28.7 57.55 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.573 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.39 -34.34 54.9 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.199 0.523 . . . . 0.0 109.827 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.949 ' HB3' ' HE3' ' A' ' 104' ' ' MET . 4.5 mm? -58.76 -7.97 1.17 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.691 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.694 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.4 mp -107.84 27.83 8.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.404 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.9 pt-20 -171.59 3.24 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.521 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.964 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.332 0.587 . . . . 0.0 111.85 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.42 -2.46 0.32 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.361 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 9.6 m-20 78.27 -30.12 0.16 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.42 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.87 -31.88 65.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.074 0.464 . . . . 0.0 109.83 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.964 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.9 OUTLIER -76.37 -23.3 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.775 177.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.629 ' HB2' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -75.27 -23.75 57.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.049 177.172 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.524 HD12 HD23 ' A' ' 101' ' ' LEU . 3.7 mp -91.07 -45.67 8.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.3 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -39.6 92.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.056 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.949 ' HE3' ' HB3' ' A' ' 93' ' ' LEU . 0.1 OUTLIER -59.98 -33.13 71.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.491 -179.56 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.712 HD21 HD13 ' A' ' 70' ' ' LEU . 17.3 mt -85.37 -12.35 52.37 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.742 0.306 . . . . 0.0 110.946 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -8.62 17.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.783 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -142.89 132.54 11.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.87 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 13.8 Cg_exo -69.88 1.62 4.35 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.893 2.395 . . . . 0.0 111.913 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -120.37 -26.56 5.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.272 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.93 -45.24 90.13 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.689 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -57.19 -26.28 60.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.062 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -88.28 -46.58 9.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.256 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 t -69.3 -33.53 73.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.874 0.369 . . . . 0.0 110.713 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.681 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 6.8 mmtt -78.85 -27.81 44.2 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.185 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.81 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -72.39 -55.88 11.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.298 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.467 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 20.2 t0 -52.91 -39.01 62.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 177.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -39.66 75.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.423 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.81 -22.07 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.043 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.846 HG21 ' CE1' ' A' ' 82' ' ' HIS . 56.1 t -65.3 -44.77 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.938 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.14 -25.93 65.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.505 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.2 t -86.92 -31.39 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.857 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -71.98 -40.53 68.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.992 179.178 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' A' ' 128' ' ' LYS . 81.1 mm-40 -68.48 -32.01 71.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.159 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.471 ' HA ' ' HG3' ' A' ' 128' ' ' LYS . . . -78.71 -10.99 59.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.923 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.832 ' HA ' ' HB3' ' A' ' 130' ' ' ALA . 1.6 t60 -117.52 -0.1 11.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.105 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -81.69 -95.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.413 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.24 21.88 7.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.698 0.285 . . . . 0.0 111.767 -178.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.471 ' HG3' ' HA ' ' A' ' 124' ' ' ALA . 12.6 mttt -88.47 -154.41 0.28 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 111.081 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.48 -0.67 56.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.151 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.832 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . . . -87.4 20.66 2.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.064 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.16 124.59 20.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.069 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -87.93 138.45 31.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.9 -26.67 21.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.57 109.04 4.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.0 m -104.04 -0.78 10.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -90.0 -14.25 34.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.893 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 84.6 p -84.32 -5.82 59.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.857 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.22 -174.74 5.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 16.9 p -93.52 154.61 17.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.937 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 142' ' ' PRO . . . -100.5 -84.9 1.83 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.48 106.75 34.82 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.461 0.172 . . . . 0.0 111.126 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 140' ' ' GLY . 53.0 Cg_exo -55.44 125.52 19.41 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.636 2.224 . . . . 0.0 112.351 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 55.7 p -83.83 172.6 12.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.821 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.0 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 CA-C-O 119.993 -0.337 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -72.29 -45.74 0.43 Allowed 'Cis proline' 0 C--N 1.347 0.479 0 C-N-CA 123.765 -1.348 . . . . 0.0 112.414 0.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.86 140.35 30.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.024 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.27 90.58 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.615 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.8 t -93.26 52.55 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.351 . . . . 0.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.57 158.0 0.09 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.271 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -165.15 25.55 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.129 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 59.22 -92.49 0.04 OUTLIER 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.141 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -117.27 -95.24 0.48 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.03 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -170.41 79.59 0.59 Allowed Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.02 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -82.07 39.5 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.652 2.235 . . . . 0.0 112.348 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.48 96.97 8.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.16 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.76 85.49 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -70.58 136.76 49.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.957 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.79 126.22 35.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -109.37 136.44 20.2 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.37 121.15 8.38 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.475 2.116 . . . . 0.0 112.262 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -79.54 93.81 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.81 119.13 12.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.922 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.89 41.39 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -88.57 16.84 6.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.862 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.67 -169.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.001 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.18 53.92 2.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.999 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.0 67.91 3.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.483 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -12.11 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.791 0.329 . . . . 0.0 111.043 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -15.87 49.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.905 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.406 ' HA ' ' C ' ' A' ' 28' ' ' PRO . 2.8 t30 -97.07 139.9 21.77 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 27' ' ' ASN . 11.5 Cg_exo -71.75 153.84 97.42 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.762 -1.349 . . . . 0.0 112.25 0.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -93.54 -79.19 0.41 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.997 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -100.17 109.14 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.015 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -101.22 9.89 41.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.766 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.3 tt -97.69 -74.56 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -105.41 53.85 0.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 30' ' ' GLN . . . -74.08 -168.07 0.58 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.017 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -106.23 96.27 13.07 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.953 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.35 -9.8 25.94 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.431 2.087 . . . . 0.0 112.343 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -96.48 91.24 5.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.019 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.5 m -88.45 2.12 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.1 24.14 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.846 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.08 -169.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.004 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -75.59 -158.79 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.858 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -121.52 80.63 38.79 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.071 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -69.87 86.42 0.6 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.426 2.084 . . . . 0.0 112.177 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -86.34 43.17 1.04 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.196 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.8 m -90.73 4.4 6.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.097 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -98.07 15.78 23.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.024 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 13.7 p -95.09 144.94 8.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.113 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -83.3 156.81 22.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.808 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -80.52 103.37 2.18 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.781 -0.724 . . . . 0.0 112.463 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -106.51 92.41 4.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -86.06 114.93 59.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.96 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.72 166.84 17.15 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.561 2.174 . . . . 0.0 112.524 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.71 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -91.22 150.12 21.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.67 179.521 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.731 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.58 -167.44 0.78 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.433 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 1.03 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.57 -43.97 65.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.852 -178.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -57.72 -51.23 70.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.874 0.369 . . . . 0.0 110.747 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.514 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.19 -38.59 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.248 179.166 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.03 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.0 mt -63.96 -42.89 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.064 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.18 -15.59 60.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.058 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.6 m -73.86 -6.98 50.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.884 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.64 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.24 61.85 57.4 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.039 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.588 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 45.1 Cg_exo -56.03 -53.07 5.98 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.577 2.185 . . . . 0.0 113.248 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.4 Cg_endo -98.27 24.03 0.24 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.529 2.153 . . . . 0.0 112.674 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.64 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -129.35 -94.88 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.75 -178.659 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.689 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.21 37.07 2.47 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -177.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.588 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.49 -23.61 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.918 0.39 . . . . 0.0 110.825 179.336 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.576 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -129.75 28.65 5.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.841 179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.51 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.37 -54.98 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.965 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.689 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -75.52 18.1 0.25 Allowed 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -177.483 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.729 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.42 -32.58 17.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.239 0.542 . . . . 0.0 110.445 179.619 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.125 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.15 11.6 4.74 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.037 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.471 ' HG2' ' HG3' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -129.26 -8.54 4.75 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.145 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -127.34 -14.17 5.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.774 0.321 . . . . 0.0 110.969 179.852 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.631 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.31 -10.99 59.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.708 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 11.5 t80 -49.01 -55.41 20.78 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.68 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.6 Cg_exo -62.34 -9.73 16.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.087 1.858 . . . . 0.0 112.157 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.71 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.5 mm? -98.81 -28.21 13.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.579 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.75 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.8 mm -70.6 -40.47 77.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.732 0.301 . . . . 0.0 111.244 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.778 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.7 mt-30 -52.62 -19.3 2.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.351 0.596 . . . . 0.0 110.103 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.26 -38.88 30.04 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.959 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.75 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.2 -48.63 33.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.24 0.543 . . . . 0.0 110.167 179.413 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.848 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.5 m-70 -111.97 146.18 34.26 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.467 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.587 ' HD2' HD12 ' A' ' 85' ' ' LEU . 36.6 Cg_exo -57.18 78.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.544 2.163 . . . . 0.0 112.014 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.778 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 48.17 37.17 7.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.062 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.848 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.3 OUTLIER -92.48 4.99 52.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -179.351 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.635 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.88 -138.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.948 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.85 -10.14 53.38 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.793 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.647 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.1 tptt -159.96 -23.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.694 -0.253 . . . . 0.0 111.536 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.844 HG21 HG13 ' A' ' 115' ' ' VAL . 69.2 mt -49.68 -81.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.125 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -55.95 -37.72 69.39 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.636 0.255 . . . . 0.0 110.672 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.63 -28.45 59.93 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.218 -0.991 . . . . 0.0 110.648 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.8 ttp -76.91 -33.99 57.74 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.352 0.596 . . . . 0.0 109.718 177.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.71 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -60.23 -4.61 0.85 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.829 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.651 HD13 ' HA3' ' A' ' 71' ' ' GLY . 3.4 mp -110.04 25.88 11.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 176.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -168.04 1.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.358 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.92 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.21 -153.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.439 0.638 . . . . 0.0 111.955 -179.531 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -59.82 -2.62 0.41 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.302 178.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.591 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.49 -36.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.163 -179.466 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 3.0 m -65.28 -27.35 68.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.847 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.92 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -82.99 -25.62 32.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.587 177.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.678 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 2.3 tp -75.14 -25.33 58.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.701 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.75 -48.02 7.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.323 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.461 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.3 OUTLIER -65.27 -37.01 85.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.429 -178.216 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.71 ' HE1' ' HB3' ' A' ' 93' ' ' LEU . 8.2 ptm -60.09 -38.17 82.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.797 0.332 . . . . 0.0 111.083 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.825 HD23 HD13 ' A' ' 58' ' ' LEU . 40.2 mt -81.64 -11.43 59.1 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.953 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.48 -9.11 14.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.857 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.836 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -140.77 126.95 11.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.661 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 17.1 Cg_exo -68.07 6.72 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.876 2.384 . . . . 0.0 112.314 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 107' ' ' SER . 2.1 tt0 -127.8 -26.43 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.1 -46.78 85.72 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.268 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -49.99 -23.71 2.18 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.779 178.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 112' ' ' ARG . 15.1 mtp180 -92.96 -62.96 1.28 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.2 t -50.05 -29.54 9.03 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.126 0.489 . . . . 0.0 109.791 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.667 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -81.0 -42.98 20.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.666 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.844 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -63.97 -58.15 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -50.98 -42.72 60.36 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.734 0.302 . . . . 0.0 110.868 178.32 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 113' ' ' SER . 4.4 mt-10 -70.31 -32.46 70.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.327 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.01 -24.74 64.25 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.113 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.721 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -63.38 -46.11 96.27 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 CA-C-O 121.291 0.567 . . . . 0.0 109.664 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.44 -26.27 63.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.742 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 7.9 t -86.98 -32.63 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.741 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.61 -38.29 77.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.93 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.452 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 14.6 mm100 -74.16 -27.0 60.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.962 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.984 ' HB1' ' HB3' ' A' ' 130' ' ' ALA . . . -83.54 -2.4 55.91 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.073 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.431 ' CG ' ' HB3' ' A' ' 131' ' ' ALA . 0.4 OUTLIER -121.59 -26.14 4.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.044 178.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -83.75 -38.54 21.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.019 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.596 ' HB3' ' HD2' ' A' ' 128' ' ' LYS . . . -95.5 -62.85 1.23 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.758 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.733 ' HD2' ' H ' ' A' ' 128' ' ' LYS . 0.0 OUTLIER -98.14 169.06 9.87 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.852 0.834 . . . . 0.0 111.282 179.23 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.11 22.47 3.73 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.575 173.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.984 ' HB3' ' HB1' ' A' ' 124' ' ' ALA . . . -57.03 -37.66 72.05 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.586 -175.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.431 ' HB3' ' CG ' ' A' ' 125' ' ' HIS . . . -79.81 101.13 8.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.006 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -91.17 164.88 13.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -10.45 59.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.882 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -76.78 126.68 31.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.12 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 17.6 m -95.31 15.27 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.165 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -79.9 -40.13 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.948 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.81 -7.55 54.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.963 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -79.65 74.35 6.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.032 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 15.2 p -115.78 -173.82 2.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -86.9 -71.18 1.3 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.549 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 9.9 m -94.94 147.4 33.01 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.592 0.234 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -64.87 140.31 66.22 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.439 2.093 . . . . 0.0 112.294 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.534 HG23 ' H ' ' A' ' 144' ' ' VAL . 0.0 OUTLIER -104.67 -63.65 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.014 -179.814 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.534 ' H ' HG23 ' A' ' 143' ' ' THR . 3.9 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.154 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 112.551 -0.22 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.62 175.62 6.88 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.465 2.11 . . . . 0.0 112.381 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 mp -80.65 -9.36 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -99.44 127.0 9.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.509 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.47 173.21 7.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.856 0.36 . . . . 0.0 110.907 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.28 -0.73 29.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.133 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.31 20.87 16.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.969 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.79 -28.19 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -137.42 91.21 2.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.091 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.14 118.88 59.37 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.52 4.02 4.85 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.606 2.204 . . . . 0.0 112.455 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.57 67.0 9.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.138 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.3 t -77.73 -31.73 17.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.951 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -77.46 174.76 10.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.75 55.89 3.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.2 100.99 49.17 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.59 -176.43 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.494 2.129 . . . . 0.0 112.275 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -165.91 0.59 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.96 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.39 145.75 55.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -98.01 108.49 21.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.926 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -0.82 33.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.91 139.12 56.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.027 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.52 -29.15 24.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.068 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.19 88.5 0.73 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 13.7 p -95.82 -28.58 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.887 0.375 . . . . 0.0 110.988 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -88.9 104.09 16.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.542 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 2.1 m-20 -86.94 -51.07 0.44 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.579 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 27' ' ' ASN . 38.2 Cg_endo -66.03 103.63 0.64 Allowed 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.037 1.825 . . . . 0.0 112.236 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -177.15 3.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -79.13 -26.23 42.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 57.32 26.94 13.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.061 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 tp -95.48 119.51 34.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -105.01 81.13 1.7 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.87 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.14 177.32 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -93.66 128.58 41.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.997 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.59 92.42 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.536 2.157 . . . . 0.0 112.352 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.09 108.67 19.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.0 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.9 p -91.05 140.9 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.938 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.35 74.1 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.04 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -30.6 22.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.842 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.55 83.3 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.08 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -80.56 110.14 15.79 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.68 175.08 11.75 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.0 112.5 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.8 173.92 12.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.936 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.4 ' H ' HG22 ' A' ' 45' ' ' VAL . 3.5 m -76.4 -172.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.039 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.58 82.42 2.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 m -111.31 56.11 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.027 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -74.45 -34.02 63.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.802 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.55 -76.0 1.25 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.373 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -84.69 75.2 10.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.853 0.359 . . . . 0.0 110.733 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.561 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 6.3 mt-10 -70.04 -51.49 14.37 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.446 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 85.7 Cg_endo -82.99 125.63 4.18 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.257 1.971 . . . . 0.0 112.706 -179.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.764 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -83.39 151.55 25.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.535 179.12 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.889 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -170.21 -159.37 0.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.751 179.501 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -60.69 -37.31 81.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.313 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.3 m -59.8 -46.46 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.349 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.92 -40.65 94.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.191 178.531 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.626 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.31 -47.19 84.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.561 179.214 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.94 -12.68 61.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.217 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' A' ' 57' ' ' MET . 46.3 t -76.39 -7.36 54.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.726 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -134.4 60.49 43.65 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.185 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.559 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.8 Cg_exo -55.05 -51.29 10.6 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.534 2.156 . . . . 0.0 113.284 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 79.3 Cg_endo -89.04 -23.42 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.245 1.963 . . . . 0.0 112.622 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.726 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 43.3 tt0 -78.68 -91.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.843 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -95.24 -90.08 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.916 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.463 ' H ' ' HB2' ' A' ' 65' ' ' GLU . 0.4 OUTLIER 73.53 -40.92 0.48 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.379 0.425 . . . . 0.0 110.937 -179.201 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.54 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.8 mtpt -124.83 18.16 8.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.358 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.843 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -114.75 -43.57 3.13 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.396 -179.469 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.476 ' HG3' ' CB ' ' A' ' 65' ' ' GLU . 30.4 mtm -77.22 -9.63 58.91 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -39.61 80.49 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.332 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.061 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -144.65 28.71 1.89 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.817 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -138.47 -9.32 1.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.583 0.23 . . . . 0.0 111.308 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.06 -14.84 5.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.783 0.325 . . . . 0.0 111.007 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.719 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.01 -25.19 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.855 -179.614 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.483 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.0 t80 -42.75 -55.69 6.94 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.169 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 19.3 Cg_endo -59.7 -18.23 46.97 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.976 1.784 . . . . 0.0 112.386 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 53' ' ' LEU . 84.8 mt -99.09 -22.15 15.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.991 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.626 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.9 mm -65.46 -37.87 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.895 0.379 . . . . 0.0 110.431 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.4 mt-30 -53.93 -18.11 3.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.78 -34.57 30.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.08 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.483 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -79.35 -40.78 29.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.067 -178.326 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.735 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.4 m-70 -118.12 159.68 42.17 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.234 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.69 ' HG2' HD23 ' A' ' 85' ' ' LEU . 37.8 Cg_endo -64.71 75.17 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.31 2.007 . . . . 0.0 111.796 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 43.8 p 45.73 36.09 2.54 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.982 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.69 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -87.23 1.84 51.92 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.045 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.658 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -65.72 -143.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.095 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.31 -11.66 60.39 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.301 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.888 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.1 ttpt -160.47 -21.96 0.06 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.812 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -49.03 -80.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.061 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.6 -39.22 67.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.575 0.226 . . . . 0.0 110.768 -179.37 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.66 -27.54 64.04 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.888 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.8 ttm -76.46 -36.42 57.92 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.516 0.674 . . . . 0.0 109.561 177.041 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.661 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -57.71 -6.83 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.432 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.14 27.39 9.33 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.43 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.6 pt-20 -170.84 2.57 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.091 -0.958 . . . . 0.0 111.357 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.34 -150.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.456 0.646 . . . . 0.0 111.77 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.563 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 8.1 t0 -59.09 -3.97 0.44 Allowed 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.043 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.585 ' H ' HG12 ' A' ' 96' ' ' ILE . 8.5 m120 78.79 -26.48 0.17 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.483 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.39 -32.12 60.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.103 0.477 . . . . 0.0 109.865 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.2 mt-10 -74.79 -24.85 58.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.837 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.642 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.7 tp -75.02 -24.66 58.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.958 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.9 mp -90.47 -47.03 7.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.122 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -37.12 85.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.352 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.681 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 6.0 ptm -60.07 -39.07 84.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.742 0.306 . . . . 0.0 110.793 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.588 HD21 ' HB3' ' A' ' 70' ' ' LEU . 59.8 mt -78.33 -13.13 59.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.541 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -109.41 -5.13 15.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.037 -177.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.837 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.7 t -147.31 139.69 14.21 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.228 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.659 ' O ' HG21 ' A' ' 54' ' ' THR . 85.8 Cg_endo -80.05 2.92 8.05 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.981 2.454 . . . . 0.0 112.009 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -122.87 -18.96 6.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.306 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.837 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -72.24 -50.62 25.96 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.844 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.889 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.1 tt -50.09 -34.19 21.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.112 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -85.69 -60.04 2.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.228 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.5 m -53.63 -35.86 61.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.866 0.365 . . . . 0.0 111.027 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.647 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.2 mmtt -78.73 -28.59 44.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.557 179.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.812 HG13 HG21 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -71.07 -50.63 40.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.388 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.415 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.3 -38.82 81.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.432 177.974 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.1 -33.32 67.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.595 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.807 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -65.43 -30.11 70.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.656 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.735 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -56.61 -53.38 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.699 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.33 -25.68 16.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.348 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 5.1 t -86.81 -32.55 6.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.422 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.831 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.28 -39.36 74.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.086 179.077 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.492 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -73.13 -26.91 61.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.659 178.049 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.61 1.73 54.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.504 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.528 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -124.5 -27.24 3.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.934 0.397 . . . . 0.0 110.63 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.606 ' HG3' HD12 ' A' ' 122' ' ' LEU . 58.9 mm-40 -89.41 -76.53 0.41 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.701 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -82.74 8.48 12.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.291 -177.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.66 ' HE3' ' HB2' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -69.76 -149.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.005 0.431 . . . . 0.0 110.574 179.082 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.433 ' C ' ' H ' ' A' ' 131' ' ' ALA . 0.2 OUTLIER -85.91 25.07 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.468 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.66 ' HB2' ' HE3' ' A' ' 128' ' ' LYS . . . -72.54 19.53 0.08 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.822 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 129' ' ' GLU . . . -84.98 37.42 0.66 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.886 0.374 . . . . 0.0 111.34 -179.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -79.81 -79.09 0.15 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.971 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -63.75 1.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.8 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.47 117.9 12.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.047 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.3 t -94.23 -51.26 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.048 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -72.66 103.92 3.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.1 51.24 0.95 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 118.67 10.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.103 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.05 178.1 6.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.824 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -88.71 122.67 6.47 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.611 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.541 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 2.6 t -83.78 -51.26 0.63 Allowed Pre-proline 0 C--N 1.329 -0.3 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.541 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 48.3 Cg_exo -56.33 150.37 50.47 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.251 1.967 . . . . 0.0 112.408 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.8 p -102.92 -39.83 6.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.898 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.192 -179.816 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.24 -10.42 25.72 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.569 2.18 . . . . 0.0 112.332 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -70.31 0.7 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.69 111.27 3.91 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.501 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.7 t -86.53 142.09 28.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.11 143.44 32.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.156 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.19 63.04 1.83 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -158.47 153.27 24.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.115 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -114.94 118.21 32.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.044 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.584 ' HB ' ' HD3' ' A' ' 11' ' ' PRO . 3.3 m -63.49 -49.9 75.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.488 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.584 ' HD3' ' HB ' ' A' ' 10' ' ' THR . 52.5 Cg_exo -55.17 125.05 17.87 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.101 1.868 . . . . 0.0 112.219 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.48 34.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.211 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.98 92.11 3.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.043 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.82 156.47 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.15 151.19 23.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.89 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 p -103.24 114.73 64.84 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.838 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.45 96.42 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.497 2.131 . . . . 0.0 112.495 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -91.33 97.05 10.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.738 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -76.36 0.29 20.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.012 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -81.6 73.7 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.822 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -82.36 109.56 16.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.56 133.72 43.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.051 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -173.55 1.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.59 84.15 0.99 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.474 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 13.5 m -101.57 176.28 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.767 0.318 . . . . 0.0 111.102 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.45 123.49 33.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 m-20 -95.93 145.58 29.81 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.986 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.13 -70.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.605 2.203 . . . . 0.0 112.348 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -88.78 109.15 19.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -99.34 -81.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.049 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 -3.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.4 mt -94.44 100.18 12.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -102.47 102.38 12.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 86.27 1.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.084 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -103.41 147.33 34.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -83.08 162.63 73.35 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.478 -1.468 . . . . 0.0 112.393 0.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.56 -172.01 3.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.878 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.85 110.49 14.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.82 130.2 45.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.865 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.419 ' HG3' ' H ' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -84.48 168.37 15.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.92 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.419 ' H ' ' HG3' ' A' ' 40' ' ' MET . 4.5 pt20 -83.78 127.12 33.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.926 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.72 95.15 30.02 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.865 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -67.86 107.91 1.59 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.545 2.163 . . . . 0.0 112.256 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.1 61.18 6.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.4 m -90.17 30.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.107 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -91.4 -74.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 t -102.32 154.61 5.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.023 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -91.0 -2.44 57.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.808 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.52 -150.35 25.24 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.426 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -87.92 129.26 35.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.565 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 1.6 mm-40 -84.69 -50.96 0.57 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.558 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 31.6 Cg_endo -63.47 112.06 1.65 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.204 1.936 . . . . 0.0 112.53 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.782 ' HB2' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -72.03 135.09 46.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.823 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.864 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.14 -176.18 1.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.042 178.59 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.997 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.48 -43.7 45.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.839 -179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.666 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 50.4 m -60.36 -48.14 83.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.026 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.666 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.22 -42.06 85.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.294 0.569 . . . . 0.0 110.472 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.997 HD12 ' HA ' ' A' ' 55' ' ' ALA . 9.5 mt -62.38 -45.17 94.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.19 -15.22 44.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.966 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 t -76.08 -6.32 50.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -132.69 59.84 46.0 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.104 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.61 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.9 Cg_exo -55.23 -52.65 7.33 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.449 2.099 . . . . 0.0 113.122 -179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.6 Cg_endo -97.97 27.51 0.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.528 2.152 . . . . 0.0 112.81 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.716 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 10.4 tt0 -136.04 -92.56 0.27 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.772 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.01 36.36 2.7 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.038 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.538 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -68.06 -20.74 64.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 110.609 178.711 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.645 ' HA ' HD11 ' A' ' 70' ' ' LEU . 9.4 pttt -131.43 26.89 4.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.895 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.458 ' N ' HD21 ' A' ' 70' ' ' LEU . 3.9 mt-30 -131.02 -56.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.772 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -77.98 18.35 0.5 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.645 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.1 -32.76 17.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.31 0.576 . . . . 0.0 110.138 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.072 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -131.33 12.6 5.48 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.739 178.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -128.66 -3.42 5.34 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.99 -19.79 4.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.83 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.683 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.29 -22.17 52.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.107 -178.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.648 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.8 t80 -44.55 -55.17 10.78 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.102 -177.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 31.5 Cg_exo -60.4 -15.71 37.28 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.166 1.911 . . . . 0.0 112.711 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.782 HD23 ' HB2' ' A' ' 53' ' ' LEU . 0.1 OUTLIER -98.65 -28.41 13.55 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.341 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.8 mm -61.66 -40.52 86.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.577 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.863 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 19.0 mt-30 -52.31 -17.43 1.15 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.914 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.22 -35.65 23.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.079 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.9 -37.62 58.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.925 -179.345 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.763 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.8 m-70 -121.22 162.64 34.62 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.502 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -67.46 71.67 0.64 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.298 1.998 . . . . 0.0 111.86 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.863 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.4 p 49.11 32.35 4.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.119 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 27.4 mt -84.71 5.91 26.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.22 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.53 -141.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.898 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.31 -10.67 34.49 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.456 -0.878 . . . . 0.0 111.608 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.857 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.1 OUTLIER -156.3 -25.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 179.791 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.849 HG21 HG13 ' A' ' 115' ' ' VAL . 56.6 mt -49.26 -85.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-O 120.629 0.252 . . . . 0.0 111.558 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.072 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.98 -40.0 66.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.0 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.59 -30.02 58.55 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.168 -1.015 . . . . 0.0 111.029 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.857 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.77 -25.62 32.61 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.77 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.3 mm? -60.77 -8.08 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.677 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.561 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.9 mm? -105.79 25.84 10.35 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.568 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 3.9 pt-20 -167.3 1.58 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.547 -178.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.899 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.0 -152.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.448 0.642 . . . . 0.0 111.963 -179.137 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.5 t70 -59.08 -2.95 0.3 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.272 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.7 m-80 78.14 -28.78 0.16 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.28 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.59 -31.03 64.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.132 0.491 . . . . 0.0 109.839 177.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.899 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.8 OUTLIER -78.17 -22.29 48.9 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.633 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.4 tp -75.14 -24.74 58.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.782 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.403 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.6 mp -91.15 -47.3 7.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.221 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -37.18 86.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.59 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.804 ' HB2' HD22 ' A' ' 111' ' ' LEU . 8.3 ptm -59.53 -38.74 81.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.572 0.225 . . . . 0.0 111.033 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 58' ' ' LEU . 4.0 mt -86.62 -7.71 58.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.11 0.481 . . . . 0.0 110.093 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 68.7 mm-40 -108.99 -5.8 15.92 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.771 -177.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.721 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.3 t -146.05 130.95 8.98 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 111.447 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.472 ' O ' HG21 ' A' ' 54' ' ' THR . 57.0 Cg_endo -70.68 8.6 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.552 2.168 . . . . 0.0 112.076 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.67 -27.51 2.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.308 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.721 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -63.95 -44.57 92.4 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.054 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.15 -42.23 13.63 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 175.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.437 ' HG2' ' N ' ' A' ' 113' ' ' SER . 2.3 ttt180 -79.68 -64.91 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.522 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.437 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 33.3 t -48.65 -52.63 22.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.788 0.328 . . . . 0.0 111.328 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 10.5 mmtm -60.21 -30.96 69.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.05 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.849 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.19 -53.76 20.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -36.91 62.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.031 0.443 . . . . 0.0 110.491 177.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.81 -33.96 60.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.985 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.12 -24.37 65.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.043 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.763 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -65.49 -49.2 79.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.68 176.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.83 -27.49 60.2 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.6 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 6.5 t -84.43 -30.28 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.691 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.16 -37.99 61.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.157 179.122 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -75.28 -20.25 59.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.028 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.48 -15.69 34.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.636 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -113.21 -50.9 2.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.187 -178.413 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 122' ' ' LEU . 46.2 mm-40 -57.23 -67.9 0.28 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -94.22 53.63 1.76 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . 3.9 pttt -64.18 118.01 7.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.626 -175.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.423 ' HG3' ' H ' ' A' ' 129' ' ' GLU . 0.0 OUTLIER -83.19 8.47 13.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.225 178.596 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -85.5 20.5 2.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.005 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.1 -2.06 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.021 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -74.0 -62.53 1.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 74.13 10.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.66 -49.17 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.068 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.0 m -94.31 167.76 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.215 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -79.27 -11.9 59.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.915 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.2 p -94.71 140.21 30.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.917 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.93 167.18 19.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.067 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 27.8 p -109.46 139.77 44.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -91.84 145.19 17.58 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.526 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 29.5 t -99.22 122.88 50.68 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.489 0.185 . . . . 0.0 111.027 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.55 125.33 13.69 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.508 2.139 . . . . 0.0 112.234 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 28.3 m -76.83 -29.52 55.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.957 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.084 -179.923 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 CA-C-O 120.156 -0.247 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -78.82 -164.3 3.91 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 123.394 -1.502 . . . . 0.0 112.35 0.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 85.28 5.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.845 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.88 -165.49 37.49 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.634 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.94 -175.36 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.781 0.324 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.61 103.84 5.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.122 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -84.54 166.04 17.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.078 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.03 127.65 15.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.218 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 55.93 88.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.288 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.431 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 2.7 t -133.5 124.77 18.25 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.938 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 10' ' ' THR . 26.6 Cg_exo -63.12 87.26 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.591 2.194 . . . . 0.0 112.318 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.56 0.15 38.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.993 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.5 m -101.58 125.69 55.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.043 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 mtm-85 -95.59 104.0 15.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.008 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.74 88.5 2.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.924 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -104.28 143.42 26.64 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -74.54 163.1 91.21 Favored 'Cis proline' 0 C--N 1.349 0.56 0 C-N-CA 123.676 -1.385 . . . . 0.0 112.14 0.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -85.49 -178.97 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.844 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -66.1 173.54 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.464 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -100.27 12.49 36.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.778 179.925 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -93.59 108.61 20.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.969 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.13 -75.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.37 53.07 2.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.14 -1.26 48.13 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.555 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -104.71 108.75 25.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.937 0.398 . . . . 0.0 110.981 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.496 ' HG3' ' H ' ' A' ' 27' ' ' ASN . 0.9 OUTLIER -85.84 180.0 6.93 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.987 -179.732 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.496 ' H ' ' HG3' ' A' ' 26' ' ' ARG . 89.6 m-20 -88.87 154.54 50.08 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.781 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -82.82 175.26 39.42 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.515 -1.452 . . . . 0.0 112.429 0.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.12 -163.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.84 167.85 16.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.774 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -123.48 68.63 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.928 0.394 . . . . 0.0 111.027 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mp -80.46 161.01 25.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.858 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -91.46 42.16 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.994 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.54 -5.52 55.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.94 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.6 116.86 59.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.935 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.01 -26.41 31.14 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.585 2.19 . . . . 0.0 112.205 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.82 46.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.058 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 p -82.24 122.37 36.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.27 77.66 1.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.1 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.5 ptt? -95.22 -14.05 24.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -154.13 146.25 23.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.738 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.99 110.93 3.08 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.179 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.81 90.89 0.82 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.578 2.185 . . . . 0.0 112.181 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.37 127.23 32.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.207 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.67 144.38 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.854 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.08 -79.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.2 p -86.23 145.02 8.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.08 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 171.64 7.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.97 70.0 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.672 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.0 87.47 4.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.804 0.335 . . . . 0.0 110.809 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.742 ' H ' ' HA ' ' A' ' 52' ' ' PRO . 3.8 mm-40 -90.84 -48.46 0.36 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.964 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.742 ' HA ' ' H ' ' A' ' 51' ' ' GLU . 67.4 Cg_endo -89.93 -173.71 7.3 Favored 'Cis proline' 0 C--N 1.356 0.953 0 C-N-CA 124.657 -0.976 . . . . 0.0 112.772 1.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.848 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -69.29 145.05 53.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.269 -179.502 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.797 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.46 -158.82 0.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.279 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.752 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -60.62 -40.64 92.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.447 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.3 m -58.27 -46.15 86.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.398 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.848 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.45 -43.33 93.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.12 178.558 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.752 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.93 -48.74 75.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.487 178.992 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.29 -9.69 49.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.665 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.7 m -84.73 -8.38 58.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.217 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.542 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -135.14 56.43 16.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.553 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.542 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 92.2 Cg_endo -96.99 127.55 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.909 2.406 . . . . 0.0 112.845 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.476 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 74.5 Cg_endo -98.7 21.24 24.35 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.248 -1.147 . . . . 0.0 112.318 -0.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.404 ' HB3' ' H ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -50.79 -84.84 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.566 -178.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.481 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 1.7 mm-40 -104.21 20.6 18.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.852 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.529 ' HG3' ' HB3' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -57.42 -32.17 66.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.001 179.864 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.627 ' C ' HD21 ' A' ' 70' ' ' LEU . 35.9 mtmt -131.94 29.21 4.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.216 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 4.0 mt-30 -127.37 -48.1 1.44 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.56 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -81.03 13.76 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.179 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.798 HD22 ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -81.55 -40.35 23.24 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 120.906 0.384 . . . . 0.0 110.121 179.328 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.052 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.8 36.13 2.41 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.84 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 1.4 pt-20 -150.85 -11.85 0.23 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.434 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.92 -15.29 5.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 110.687 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.708 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.92 -12.43 59.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.31 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.476 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 9.1 t80 -48.19 -54.91 21.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.818 -177.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.7 Cg_endo -65.03 -8.08 17.2 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.114 1.876 . . . . 0.0 112.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.589 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.6 mm? -98.54 -28.19 13.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.267 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.779 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.7 mm -69.13 -40.38 80.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.322 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.937 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.9 mt-30 -51.19 -18.3 0.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.281 0.562 . . . . 0.0 110.355 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.35 -39.98 22.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.211 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.779 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.74 -44.35 61.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.091 0.472 . . . . 0.0 110.742 -179.596 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.738 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.7 m-70 -115.51 155.76 46.84 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.642 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -62.92 76.18 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.508 2.139 . . . . 0.0 111.736 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.937 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.5 p 46.84 33.7 2.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.133 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.701 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 17.9 mt -87.18 6.41 33.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.211 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.672 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.6 -137.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.961 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.1 -15.86 25.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.769 -178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.886 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.0 ttpt -156.62 -21.6 0.1 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.845 HG21 HG13 ' A' ' 115' ' ' VAL . 62.0 mt -49.54 -81.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.052 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.26 -39.3 66.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.455 0.169 . . . . 0.0 110.795 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.07 -28.03 63.3 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.093 -1.051 . . . . 0.0 110.573 176.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.886 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.7 ttm -76.32 -36.87 58.07 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.521 0.677 . . . . 0.0 109.793 177.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -56.98 -6.32 0.34 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.561 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 70' ' ' LEU . 2.3 mm? -108.75 27.7 9.17 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.419 ' H ' ' H ' ' A' ' 96' ' ' ILE . 6.5 pt-20 -170.1 1.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.195 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.958 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.16 -153.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 121.4 0.619 . . . . 0.0 111.616 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 96' ' ' ILE . 7.6 t0 -59.34 -3.14 0.37 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.139 178.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.58 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.9 -35.14 0.17 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.264 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -67.32 -25.77 66.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.833 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.958 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.56 -24.67 31.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.858 177.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -74.95 -27.19 60.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.54 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.7 mp -86.69 -46.83 9.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.36 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -37.93 85.06 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.201 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.771 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.86 -36.09 74.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.157 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 16.3 mt -86.92 -9.92 54.53 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.136 0.493 . . . . 0.0 110.1 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -107.5 -6.44 17.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.258 -176.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.856 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -148.71 130.33 7.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.636 0.255 . . . . 0.0 111.518 -179.387 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.482 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.57 -0.53 6.08 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.926 2.417 . . . . 0.0 112.465 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -123.69 -13.66 7.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.535 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.856 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -71.94 -46.04 58.96 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.016 0.436 . . . . 0.0 110.202 178.298 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.797 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.4 tt -56.17 -29.23 60.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.12 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -88.2 -51.64 5.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.266 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 m -64.02 -35.1 79.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.958 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 27.0 mmtt -78.98 -29.5 43.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.58 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.81 -51.44 40.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.158 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.65 -37.76 73.9 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.378 178.695 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -37.58 70.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.696 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.87 -26.97 69.03 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.962 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.738 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.5 t -62.13 -47.69 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.305 0.574 . . . . 0.0 109.807 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.73 -24.27 61.25 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.857 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.467 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 8.9 t -87.15 -35.42 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.421 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.78 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -66.31 -38.68 88.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.595 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 4.6 mm-40 -71.99 -29.11 63.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.406 176.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.499 ' C ' ' HG2' ' A' ' 128' ' ' LYS . . . -89.61 10.63 22.37 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.558 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.4 OUTLIER -136.59 -15.96 1.58 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.815 0.341 . . . . 0.0 110.979 179.064 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -88.67 -78.88 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.727 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.63 15.27 8.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.077 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.557 ' HD3' ' N ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -84.61 -158.14 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.837 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -87.32 27.08 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.462 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.557 ' N ' ' HD3' ' A' ' 128' ' ' LYS . . . -61.25 -28.38 69.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.412 -177.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.13 168.32 10.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -75.89 -62.41 1.6 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 5.0 pttm -80.55 141.34 35.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.049 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.82 85.82 7.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.042 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.17 158.32 2.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.44 83.6 0.81 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 54.2 p -96.24 138.12 34.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.897 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -89.69 125.11 35.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.107 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 1.2 t -98.39 126.03 43.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.79 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -103.96 37.39 3.78 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.509 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 37.6 t -101.45 129.72 26.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.433 0.158 . . . . 0.0 111.002 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.27 169.87 67.65 Favored 'Cis proline' 0 C--N 1.348 0.539 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.479 0.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 29.1 p -105.44 14.7 28.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.856 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.17 -179.864 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.117 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.62 -65.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.608 2.206 . . . . 0.0 112.166 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -91.79 101.56 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.863 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -106.41 134.35 12.09 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.594 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.1 t -102.31 -17.11 16.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.825 0.345 . . . . 0.0 110.917 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -135.55 141.81 45.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.998 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.64 -73.04 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.093 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -144.3 -44.62 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.09 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.47 124.92 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.71 -51.64 0.1 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.553 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -56.43 118.01 4.76 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.142 1.895 . . . . 0.0 112.294 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.57 13.26 22.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -107.79 82.75 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.159 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 14' ' ' ARG . 18.1 mtt85 -80.66 -67.23 0.79 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.75 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 m -95.14 140.18 30.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.757 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.475 HG12 ' HD2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -108.74 136.88 19.94 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.564 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.475 ' HD2' HG12 ' A' ' 16' ' ' VAL . 61.4 Cg_endo -73.54 -30.69 9.62 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.443 2.096 . . . . 0.0 112.133 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -93.39 161.02 14.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.81 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -63.96 129.19 39.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' H ' ' HG2' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -87.29 -163.95 1.01 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.973 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -86.25 39.09 0.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.012 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.02 -59.01 2.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.61 108.79 1.79 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -107.43 0.43 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.436 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.2 t -97.72 120.83 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.853 0.358 . . . . 0.0 111.138 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.435 ' HE ' ' HB2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -98.53 -55.87 2.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.863 179.954 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -82.76 139.36 43.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.953 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -77.66 69.85 7.15 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.604 2.203 . . . . 0.0 112.363 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.54 124.19 34.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -98.74 119.05 36.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.0 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -77.8 -16.92 58.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 120.04 19.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.886 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -104.95 -12.48 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.907 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.488 ' HB1' ' HB2' ' A' ' 37' ' ' GLN . . . -84.97 104.66 15.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.073 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.682 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 36.6 mt-30 -98.51 -52.05 0.21 Allowed Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.409 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.682 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 12.6 Cg_exo -70.78 -5.95 18.0 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.379 2.053 . . . . 0.0 112.185 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.488 ' HB2' ' HB1' ' A' ' 34' ' ' ALA . 2.0 tp60 -81.92 113.47 19.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.102 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.41 18.66 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 15.0 t -80.2 177.08 9.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.998 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.2 mtt -93.5 -169.41 2.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -100.47 153.34 19.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -154.11 135.68 9.01 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.2 132.3 46.06 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.524 2.149 . . . . 0.0 112.164 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.48 95.11 8.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.073 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.442 HG21 ' HG2' ' A' ' 109' ' ' GLU . 14.7 p -96.75 -27.65 3.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.986 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.39 96.27 8.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 m -109.18 -177.75 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.037 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -55.34 7.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.53 158.4 18.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.372 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -108.26 85.79 2.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.907 0.384 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 20.7 mm-40 -90.69 -50.98 0.33 Allowed Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.363 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.494 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 48.9 Cg_exo -56.98 152.8 41.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.208 1.939 . . . . 0.0 112.267 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.749 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -89.35 148.61 23.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.893 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.791 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.79 -161.86 0.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.666 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -59.59 -36.92 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.382 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 2.0 m -60.73 -45.7 93.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.405 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.81 -40.96 94.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.262 0.553 . . . . 0.0 110.113 178.371 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.629 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.04 -47.88 81.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.721 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -8.88 50.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 t -81.75 -9.51 59.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.007 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.638 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -135.12 60.35 39.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.163 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.632 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 51.3 Cg_exo -53.71 -51.48 10.72 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.413 2.075 . . . . 0.0 113.139 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.591 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 78.8 Cg_endo -97.44 31.05 0.15 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.591 2.194 . . . . 0.0 112.676 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.638 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 3.0 tp-100 -142.67 -93.54 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.536 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.714 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -106.88 43.87 1.12 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.55 -178.278 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.632 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -72.8 -31.78 65.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.932 0.396 . . . . 0.0 110.967 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.569 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -128.49 34.85 4.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.49 ' N ' HD21 ' A' ' 70' ' ' LEU . 38.2 tt0 -133.29 -53.86 0.9 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.876 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.714 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.2 ptt? -80.63 22.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.599 ' N ' HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.16 -40.9 12.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.118 0.485 . . . . 0.0 110.196 179.384 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.974 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -125.64 13.79 7.27 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -130.1 -2.4 4.56 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.511 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 20.4 tpp180 -127.11 -22.9 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.081 0.467 . . . . 0.0 111.107 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.99 -17.82 60.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.008 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 11.2 t80 -46.02 -54.88 14.95 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 27.6 Cg_endo -62.17 -15.27 43.15 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.121 1.88 . . . . 0.0 112.506 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.749 HD12 ' HB2' ' A' ' 53' ' ' LEU . 54.2 mt -98.74 -23.38 15.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.898 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.2 mm -66.37 -41.28 88.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.371 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.6 mt-30 -53.25 -18.37 2.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.58 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.56 -36.09 29.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.84 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.421 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.84 -51.29 14.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.68 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.749 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.2 m-70 -105.16 160.85 24.6 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.237 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.407 ' HD2' HD12 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.4 71.72 0.62 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.287 1.991 . . . . 0.0 111.949 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 50.84 38.98 21.25 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.857 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.563 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 25.2 mt -95.42 9.87 38.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.313 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.35 -141.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.733 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.45 -25.03 7.53 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.654 -178.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -156.38 12.28 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.46 0.171 . . . . 0.0 111.362 178.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.784 HG21 HG13 ' A' ' 115' ' ' VAL . 88.0 mt -76.19 -89.23 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 119.811 -0.755 . . . . 0.0 110.202 178.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.974 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.38 -40.64 59.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.075 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.66 -32.4 54.04 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.31 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.763 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -83.92 -23.12 31.32 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.815 0.341 . . . . 0.0 110.199 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.603 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.39 -6.66 2.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.389 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.589 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.7 mm? -105.14 24.25 12.33 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 176.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.3 pt-20 -166.86 1.73 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.704 -178.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.903 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.98 -151.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.376 0.608 . . . . 0.0 111.826 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.9 t0 -59.23 -3.44 0.4 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.143 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.596 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.3 m-20 78.08 -28.61 0.16 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.509 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.2 m -74.72 -25.15 58.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.903 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.5 OUTLIER -82.64 -26.15 32.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.596 177.251 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 94' ' ' LEU . 2.7 tp -75.06 -25.91 59.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.467 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.1 -47.64 9.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.065 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.417 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.74 -37.87 82.76 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.3 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.705 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.22 -35.97 72.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.268 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.588 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.5 mt -87.05 -12.85 46.08 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.259 0.552 . . . . 0.0 110.068 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 57.6 mm-40 -102.49 -8.01 21.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.19 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.834 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -147.32 134.5 10.22 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.677 0.275 . . . . 0.0 111.722 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 59.4 Cg_endo -72.18 2.19 5.22 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.69 2.26 . . . . 0.0 112.24 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 113' ' ' SER . 5.7 mt-10 -126.71 -13.7 5.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.576 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.834 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -73.11 -45.13 58.79 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.045 0.45 . . . . 0.0 110.051 177.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.791 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.0 tt -56.88 -30.74 64.17 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.119 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -89.76 -44.75 9.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.301 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -68.03 -35.66 78.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.699 -179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.573 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 23.7 mmtt -78.79 -29.42 44.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.49 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.784 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.56 -52.19 31.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.473 ' CG ' ' HE2' ' A' ' 82' ' ' HIS . 7.0 t70 -59.0 -34.88 72.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.394 177.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -29.26 48.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.868 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.763 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.99 -25.31 63.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.781 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.749 HG11 ' ND1' ' A' ' 82' ' ' HIS . 13.1 t -64.96 -51.49 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.877 177.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.35 -24.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.531 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.69 -31.96 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.82 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.68 -37.1 62.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -77.62 -22.72 50.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.098 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -81.65 -15.71 53.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.318 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -107.43 -45.5 4.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -59.0 -79.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.45 62.74 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' A' ' 128' ' ' LYS . 3.0 ptpt -64.13 123.82 20.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.79 -174.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.21 4.49 42.33 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.656 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.64 -21.28 60.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.295 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.96 126.68 31.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.988 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -72.59 -71.87 0.27 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.982 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.73 70.36 9.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.971 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.08 141.0 28.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.028 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 6.7 m -76.96 136.94 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -87.29 148.0 25.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.7 m -98.49 -21.49 16.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.944 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.95 125.92 28.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.191 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.3 156.28 18.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.896 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -101.62 -159.99 26.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.501 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.449 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 1.3 t -84.7 124.13 73.4 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.595 0.236 . . . . 0.0 111.004 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 141' ' ' VAL . 16.9 Cg_exo -67.5 82.14 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.686 2.258 . . . . 0.0 112.182 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.81 172.01 8.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.964 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.038 -179.875 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HB2' ' HB3' ' A' ' 5' ' ' SER . 38.3 Cg_exo -57.32 152.73 44.42 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.597 2.198 . . . . 0.0 112.252 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.1 mt -92.49 -34.13 14.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.67 45.84 1.57 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.397 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' A' ' 2' ' ' PRO . 23.8 p -100.46 -5.34 27.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.722 0.296 . . . . 0.0 111.068 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.88 -41.51 97.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -85.41 -178.85 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.999 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.86 -69.51 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.997 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -162.8 -40.27 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.012 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.2 p -134.62 123.46 16.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.13 -11.72 27.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.47 2.113 . . . . 0.0 112.27 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.44 71.63 10.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.032 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.4 t -107.17 139.24 29.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.081 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -90.23 68.45 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.842 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.81 140.59 37.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.538 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -97.89 -51.06 0.22 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.591 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.538 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 72.6 Cg_endo -76.12 68.61 6.6 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.186 1.924 . . . . 0.0 112.379 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -75.16 -173.1 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.946 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -79.3 59.52 2.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.55 140.1 37.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -66.38 104.82 1.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.973 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.71 -10.47 37.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.86 146.01 26.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.979 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.83 97.59 2.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.54 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.5 m -82.35 -39.67 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.839 0.352 . . . . 0.0 111.005 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.475 ' O ' ' HD3' ' A' ' 28' ' ' PRO . 9.9 mmt-85 -81.17 133.32 35.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.93 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -96.34 105.58 23.37 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.475 ' HD3' ' O ' ' A' ' 26' ' ' ARG . 31.3 Cg_exo -59.35 92.19 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.567 2.178 . . . . 0.0 112.338 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.48 ' H ' ' HG2' ' A' ' 29' ' ' GLN . 2.8 pt20 -99.74 97.96 8.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.769 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -69.83 122.17 18.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.166 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -110.42 34.51 3.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.737 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -83.01 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.57 125.24 40.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.096 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.72 -3.48 58.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -101.16 133.89 20.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.925 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -57.64 167.85 3.61 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.559 2.173 . . . . 0.0 112.391 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.11 162.4 14.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.883 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.0 t -105.2 -66.8 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.345 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.9 m -86.52 -31.8 21.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.255 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.39 79.08 8.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.116 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -166.0 125.3 1.63 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -122.24 76.59 42.73 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.28 97.91 0.71 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.85 116.07 21.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.0 p -99.57 156.23 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.895 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.5 m80 -79.9 121.7 25.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.028 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 65.5 t -99.61 127.43 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.963 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -93.78 109.99 21.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.939 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.52 41.0 3.03 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.396 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.29 59.53 3.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.866 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -90.9 106.83 17.07 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.1 -173.13 1.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.459 2.106 . . . . 0.0 112.104 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.654 HD22 HD22 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -83.71 151.76 25.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.907 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.687 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.12 -169.57 1.5 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.969 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.979 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -56.84 -31.96 65.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -50.64 61.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.676 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -57.75 -36.38 72.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.915 178.716 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.979 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.0 mt -68.22 -41.57 81.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.417 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.499 ' O ' ' HD3' ' A' ' 62' ' ' PRO . . . -61.71 -12.69 17.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.913 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 m -75.29 -13.56 60.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.62 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.798 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . . . -141.61 58.94 9.16 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.107 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 53.7 Cg_exo -51.82 -51.56 10.89 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.444 2.096 . . . . 0.0 113.063 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.598 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 65.5 Cg_endo -95.76 23.2 0.38 Allowed 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.753 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 28.2 tp60 -135.73 -90.65 0.3 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.798 ' HG2' ' HB3' ' A' ' 61' ' ' ALA . 1.1 pt-20 -106.88 29.56 6.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.755 0.312 . . . . 0.0 111.818 -176.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -67.31 -60.09 2.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.576 178.733 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.434 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.7 pttm -90.16 29.74 1.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.448 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.494 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -124.71 -46.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.967 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.738 ' HG3' ' HG3' ' A' ' 65' ' ' GLU . 43.7 mtm -74.49 -8.98 58.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.696 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.786 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -57.94 -52.53 65.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.66 0.267 . . . . 0.0 111.343 -177.807 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -123.6 23.54 6.68 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.329 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.494 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 2.2 mt-10 -136.73 2.31 2.64 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.466 0.174 . . . . 0.0 111.461 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.645 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -125.67 -34.52 2.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.656 ' HB3' HD11 ' A' ' 78' ' ' ILE . 2.3 mm? -59.5 -38.48 81.01 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.777 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -26.88 -61.54 0.18 Allowed Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -175.55 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.777 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 15.9 Cg_exo -69.18 -30.38 25.05 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.078 1.852 . . . . 0.0 112.273 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.9 mt -82.12 -17.6 45.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.972 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.656 HD11 ' HB3' ' A' ' 74' ' ' LEU . 11.4 mm -73.18 -43.18 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.88 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.4 mt-30 -50.88 -19.54 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.892 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.67 -40.18 29.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.886 178.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.487 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.79 -50.86 31.2 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.494 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.743 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.2 m-70 -109.08 153.76 42.38 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.572 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.458 ' HG2' HD13 ' A' ' 85' ' ' LEU . 26.1 Cg_endo -61.74 81.0 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.339 2.026 . . . . 0.0 111.789 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.88 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 42.0 33.47 0.37 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.641 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.537 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.8 mp -87.63 8.92 23.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.878 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.457 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -75.72 40.42 0.19 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.75 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.18 -12.64 81.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.758 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.783 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.1 ttpt -178.0 34.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.868 0.366 . . . . 0.0 110.668 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.811 HG21 HG13 ' A' ' 115' ' ' VAL . 61.7 mt -80.09 -91.88 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.85 -40.59 56.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.997 179.694 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.54 53.91 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.144 -1.026 . . . . 0.0 110.916 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.783 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.39 -25.48 33.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.508 -0.346 . . . . 0.0 110.133 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.623 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.5 mm? -59.83 -7.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.786 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -104.98 27.17 8.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -168.89 2.18 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.596 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.943 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.385 0.612 . . . . 0.0 111.712 -179.723 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.542 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.4 t0 -59.43 -3.05 0.38 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.087 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 78.63 -29.94 0.15 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.493 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -73.61 -27.87 61.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.045 0.45 . . . . 0.0 109.956 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.943 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -79.77 -23.48 42.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.097 177.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.16 -25.23 58.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.833 176.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.736 HD12 HD23 ' A' ' 101' ' ' LEU . 2.6 mp -88.4 -45.56 9.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.085 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.422 ' CD2' ' HE2' ' A' ' 114' ' ' LYS . 1.2 t60 -61.94 -45.95 91.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.759 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.692 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -54.09 -32.74 55.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.409 -179.574 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.813 HD23 HD13 ' A' ' 58' ' ' LEU . 66.5 mt -85.13 -11.68 54.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.801 0.334 . . . . 0.0 111.154 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -110.18 -6.12 15.16 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.549 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -146.8 140.18 14.86 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.678 -0.409 . . . . 0.0 112.064 -178.683 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.57 ' O ' HG21 ' A' ' 54' ' ' THR . 77.0 Cg_endo -77.01 3.69 6.41 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.668 2.246 . . . . 0.0 112.056 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -122.01 -22.61 5.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.536 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.549 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.2 p -64.35 -56.94 11.03 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 109.959 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.9 tt -51.64 -28.3 13.99 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.734 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.426 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.9 ttt85 -89.86 -60.82 1.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.08 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.426 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 50.3 m -55.65 -34.99 65.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.075 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.563 ' HD3' ' HB3' ' A' ' 100' ' ' GLU . 9.1 mttm -79.2 -32.99 44.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.714 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.811 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -66.54 -53.61 33.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 177.838 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.89 -35.72 69.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.375 178.166 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.09 -30.16 60.84 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.948 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.98 -19.64 61.85 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.615 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.743 HG11 ' ND1' ' A' ' 82' ' ' HIS . 18.1 t -68.49 -49.16 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.674 176.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.2 -27.38 63.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.603 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.486 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 7.7 t -85.32 -31.92 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.477 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.69 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.99 -41.92 73.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.826 178.697 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.509 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 3.5 mm-40 -68.82 -27.92 66.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.413 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.731 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -86.06 -12.85 49.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.891 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -115.86 8.25 14.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.971 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 10.5 mt-30 -78.14 -103.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.813 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.62 20.14 10.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 111.241 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.731 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 2.8 mttm -81.77 -144.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.959 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -80.48 8.78 6.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.971 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -80.92 -14.08 58.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.195 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.06 -15.1 58.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.24 98.18 11.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.2 111.93 19.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.891 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.02 143.05 31.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.088 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.1 m -103.93 96.82 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.137 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -93.01 -4.86 51.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.899 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 47.5 p -95.36 -31.92 13.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.934 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -86.05 -179.53 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.06 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.17 -177.25 3.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.835 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.97 -107.69 0.15 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.485 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.05 136.97 19.37 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.557 0.218 . . . . 0.0 111.017 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.33 136.28 62.41 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.57 2.18 . . . . 0.0 112.334 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.1 p -88.24 78.08 8.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.036 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.5 t . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.27 -0.872 . . . . 0.0 111.051 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 CA-C-O 120.152 -0.249 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.44 127.31 25.68 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.729 2.286 . . . . 0.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.92 -23.59 17.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.947 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.31 142.83 15.73 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.419 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.3 p -79.68 82.79 5.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.832 0.348 . . . . 0.0 110.88 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -117.18 -179.12 3.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.09 19.36 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.071 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 57.01 27.41 13.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.207 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -126.64 -59.8 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.77 125.87 7.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.812 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.83 85.08 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.444 2.096 . . . . 0.0 112.302 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.7 75.21 9.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.039 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 m -103.73 137.0 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.135 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -99.62 99.24 10.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.856 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -92.62 70.49 4.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.968 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.651 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 42.3 t -109.01 -52.05 0.07 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.631 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.651 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 46.5 Cg_exo -56.38 161.56 9.2 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.189 1.926 . . . . 0.0 112.27 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -77.22 177.38 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.59 -88.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -174.26 5.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -86.71 -18.65 30.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.909 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.68 119.52 19.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.057 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.93 128.81 36.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.77 43.29 3.22 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.485 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -109.67 169.77 3.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.362 . . . . 0.0 111.079 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.8 137.93 38.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -73.56 140.15 78.46 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.03 13.35 2.01 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.536 2.158 . . . . 0.0 112.404 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.97 150.65 20.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.961 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -78.43 -163.73 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.27 -34.84 72.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.3 tp -83.83 134.64 34.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -82.77 134.13 35.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.969 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.92 -86.3 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.064 0.459 . . . . 0.0 111.101 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.16 145.22 32.43 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -77.84 133.43 30.23 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.377 -1.51 . . . . 0.0 112.428 0.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.83 -179.74 3.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.419 ' O ' HG13 ' A' ' 38' ' ' VAL . 2.9 p -78.32 87.21 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.5 -63.87 1.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.921 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.72 148.59 24.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.926 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.1 -159.74 0.99 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.851 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 133.12 83.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.955 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.71 140.52 39.27 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.455 2.103 . . . . 0.0 112.314 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.43 96.97 4.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.098 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.3 t -93.61 92.3 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.02 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 63.1 m80 -107.63 19.71 19.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 t -101.11 54.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.45 8.49 27.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -82.08 -18.45 67.21 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.595 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -100.37 122.47 43.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.818 0.342 . . . . 0.0 110.975 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.65 137.77 54.76 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.979 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.468 ' O ' ' HG2' ' A' ' 57' ' ' MET . 95.3 Cg_endo -80.97 163.57 20.42 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.616 2.211 . . . . 0.0 112.636 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.662 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER -81.0 137.21 36.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.844 179.692 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.573 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -173.51 -174.27 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.278 178.42 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 1.044 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.66 -42.13 44.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.793 -178.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.514 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 49.8 m -59.24 -52.3 66.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 110.679 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.514 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -57.8 -40.24 79.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.044 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.9 mt -61.65 -44.33 97.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.048 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -16.53 51.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.976 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.2 t -73.93 -7.03 50.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -133.23 60.78 50.96 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.194 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.603 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 47.5 Cg_exo -55.57 -53.08 6.21 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.436 2.091 . . . . 0.0 113.06 -178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 62.5 Cg_endo -97.66 22.08 0.33 Allowed 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.536 2.157 . . . . 0.0 112.532 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.696 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 4.4 mm100 -127.69 -95.1 0.43 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.852 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.748 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -106.98 37.76 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -177.259 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.468 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -70.11 -18.26 63.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.912 179.355 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.636 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.32 24.16 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.111 179.746 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.443 ' N ' HD21 ' A' ' 70' ' ' LEU . 16.2 tt0 -131.72 -52.82 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.748 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -77.62 15.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.296 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.815 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -88.86 -28.86 20.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.266 0.555 . . . . 0.0 110.139 179.267 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.053 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.77 11.61 5.15 Favored Glycine 0 N--CA 1.441 -0.988 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.597 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -130.74 -0.69 4.29 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.544 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.17 -21.3 3.95 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.9 0.381 . . . . 0.0 110.702 179.385 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.662 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.09 -15.14 60.16 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.032 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.706 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 3.0 t80 -40.06 -54.6 4.36 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.272 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 12.6 Cg_exo -70.33 -22.59 29.27 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.175 1.916 . . . . 0.0 112.125 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.0 OUTLIER -79.61 -31.5 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.717 -178.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.772 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 7.0 mm -68.69 -42.44 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.855 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.934 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.1 mt-30 -50.78 -18.26 0.7 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.323 0.582 . . . . 0.0 110.366 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.0 -41.58 20.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.835 178.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.772 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.5 OUTLIER -69.19 -43.71 73.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.464 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.784 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 3.4 m-70 -118.78 149.38 46.38 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.302 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.798 ' HG2' HD13 ' A' ' 85' ' ' LEU . 20.8 Cg_endo -59.67 77.68 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.299 2.0 . . . . 0.0 111.594 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.934 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 16.3 p 47.02 35.54 3.45 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.87 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 83' ' ' PRO . 0.8 OUTLIER -89.04 2.89 53.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.235 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -61.26 -114.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.756 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.597 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 63.39 -1.37 2.19 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.121 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.741 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -175.98 -20.62 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.816 HG21 HG13 ' A' ' 115' ' ' VAL . 69.8 mt -50.17 -84.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -177.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.053 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -53.53 -38.17 63.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.533 0.206 . . . . 0.0 110.949 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.11 -29.81 60.03 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.59 176.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.581 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.3 ttp -76.34 -35.09 58.92 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.072 -0.564 . . . . 0.0 110.021 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.65 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.28 -11.02 1.02 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.77 -177.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.621 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.68 28.25 7.66 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.414 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.0 pt-20 -172.86 2.5 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.827 -178.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.969 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.69 -149.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.433 0.635 . . . . 0.0 111.629 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.598 ' N ' HG12 ' A' ' 96' ' ' ILE . 13.0 t0 -53.16 -10.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.852 176.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.709 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.3 OUTLIER 80.6 -25.08 0.18 Allowed 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.824 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -73.48 -31.02 63.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.969 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -73.18 -33.52 65.47 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.82 177.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.52 ' N ' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -65.72 -24.12 66.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.296 178.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.9 mp -89.51 -48.25 7.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.26 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -37.32 81.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.286 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.672 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -59.72 -35.39 74.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.168 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.815 HD21 HD13 ' A' ' 70' ' ' LEU . 15.3 mt -86.78 -11.3 51.4 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.091 0.472 . . . . 0.0 110.066 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -105.63 -7.89 18.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.37 -175.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.863 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -146.58 131.72 9.05 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.673 0.273 . . . . 0.0 111.595 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 56.4 Cg_endo -70.66 2.54 3.93 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.635 2.223 . . . . 0.0 112.257 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -125.37 -16.66 5.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.699 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.863 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.3 OUTLIER -70.64 -46.55 63.07 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.006 0.431 . . . . 0.0 110.326 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.672 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 6.2 tt -54.28 -27.53 35.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.971 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.89 -51.93 5.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.362 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.1 t -64.23 -33.91 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.797 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.551 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 12.7 mmtp -78.93 -30.21 44.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.482 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.816 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.78 -50.42 49.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.646 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -57.32 -39.23 75.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.411 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -73.04 -29.47 63.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.869 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.54 -23.16 61.72 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.851 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.703 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.8 t -65.0 -48.65 83.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.588 0 CA-C-O 121.297 0.57 . . . . 0.0 109.687 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.15 -26.73 63.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.546 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.4 t -84.61 -30.69 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.792 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.741 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.91 -39.57 61.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.797 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.438 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.5 mm100 -65.52 -31.03 71.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.152 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.617 ' HB1' ' HG2' ' A' ' 128' ' ' LYS . . . -78.91 -48.75 14.01 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.177 179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.489 ' HA ' ' HB3' ' A' ' 130' ' ' ALA . 2.5 t-80 -67.63 -22.39 65.33 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.554 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -87.62 -45.0 10.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.285 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.29 -45.25 7.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.803 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.634 ' HG3' ' N ' ' A' ' 130' ' ' ALA . 1.3 ptpt -95.86 178.51 5.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.526 0.679 . . . . 0.0 111.366 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.565 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 2.3 tt0 -90.04 46.87 1.39 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.076 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.634 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.13 -15.18 8.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.686 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.38 -88.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.271 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -76.26 126.95 31.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.003 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -80.89 -46.07 15.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.856 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -79.22 110.08 14.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.006 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.3 m -104.0 158.74 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.449 ' HB3' ' H ' ' A' ' 137' ' ' SER . 2.7 m120 -87.61 -157.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.449 ' H ' ' HB3' ' A' ' 136' ' ' ASN . 0.0 OUTLIER -82.67 58.7 4.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.98 0.419 . . . . 0.0 110.979 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.23 -173.32 3.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.067 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.71 100.18 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -100.26 -41.61 2.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.436 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 m -101.85 142.59 24.91 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.693 0.282 . . . . 0.0 111.025 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.47 168.66 3.74 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.628 2.219 . . . . 0.0 112.346 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.29 141.39 28.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.869 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.2 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.123 -179.963 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.121 0 CA-C-O 120.147 -0.252 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.14 -34.42 13.33 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.512 2.141 . . . . 0.0 112.264 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 mt -87.88 151.73 22.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.077 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.94 -130.45 4.2 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.425 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.7 t -104.97 102.89 12.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.819 0.342 . . . . 0.0 110.87 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -145.8 86.45 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.144 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.75 -77.84 0.48 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.002 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 55.02 35.65 25.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.187 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.51 21.8 8.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.208 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.439 ' H ' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -93.0 -49.99 0.28 Allowed Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.282 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.439 ' HD2' ' H ' ' A' ' 10' ' ' THR . 90.0 Cg_endo -78.5 76.71 4.32 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.094 1.863 . . . . 0.0 112.287 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.78 -3.82 57.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.181 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 p -101.42 148.89 6.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.067 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -69.83 123.98 22.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.687 179.791 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 t -100.9 150.31 22.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.14 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.607 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 5.7 t -101.2 -51.31 0.17 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.536 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.607 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 50.0 Cg_exo -56.5 -39.53 90.68 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.182 1.921 . . . . 0.0 112.302 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -85.93 93.23 8.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.792 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -75.63 161.82 28.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 tppp? -74.86 115.8 14.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.908 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -0.38 27.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.523 ' H ' ' HG3' ' A' ' 20' ' ' LYS . . . -92.65 48.24 1.36 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.032 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.26 166.31 6.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.083 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.06 49.61 1.23 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.544 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 m -94.95 64.44 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.972 0.415 . . . . 0.0 110.902 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.87 37.23 0.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.943 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.537 ' HB3' ' HD3' ' A' ' 28' ' ' PRO . 10.4 t-20 -87.25 -51.86 0.42 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.305 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' A' ' 27' ' ' ASN . 87.1 Cg_endo -81.3 83.9 2.07 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.192 1.928 . . . . 0.0 112.424 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.49 98.79 11.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.886 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -96.11 -68.41 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.063 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 56.5 33.81 23.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.924 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.08 75.56 2.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.911 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -107.62 100.58 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.927 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.04 171.63 11.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.127 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.774 ' H ' ' HA ' ' A' ' 36' ' ' PRO . 0.1 OUTLIER -93.59 -50.12 0.27 Allowed Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.68 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.774 ' HA ' ' H ' ' A' ' 35' ' ' GLN . 65.9 Cg_endo -91.93 172.87 20.63 Favored 'Cis proline' 0 C--N 1.356 0.94 0 C-N-CA 124.723 -0.949 . . . . 0.0 112.579 0.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -81.3 115.38 20.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.812 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 t -100.93 -0.94 10.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.15 137.05 33.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.3 ttt -103.55 -18.27 14.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.179 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.44 158.53 23.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.986 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.414 ' HA ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 61.32 108.26 0.03 OUTLIER Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.142 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 42' ' ' GLN . 37.4 Cg_endo -65.44 155.54 68.21 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.518 2.145 . . . . 0.0 112.265 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -87.58 -177.08 5.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.068 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -101.16 128.52 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.086 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -108.31 -26.24 10.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 22.4 t -102.32 132.4 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.012 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -87.37 -25.48 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.013 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -88.12 89.41 1.6 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.58 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.26 131.2 45.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 110.889 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -85.65 136.3 37.19 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.008 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -81.89 -165.15 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.691 2.261 . . . . 0.0 112.576 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.707 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -90.5 154.69 19.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.833 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.784 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -171.29 -169.25 0.71 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.91 179.143 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 1.022 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.59 -30.85 61.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.631 0.253 . . . . 0.0 111.297 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.2 m -67.23 -49.89 62.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.608 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.28 -39.92 84.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.212 0.529 . . . . 0.0 110.212 178.759 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.022 HD12 ' HA ' ' A' ' 55' ' ' ALA . 12.5 mt -62.7 -45.5 92.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.634 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -15.03 58.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.912 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.3 t -75.29 -10.34 59.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.696 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.2 125.54 18.96 Favored Pre-proline 0 N--CA 1.449 -0.52 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.514 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.539 ' O ' ' N ' ' A' ' 64' ' ' GLN . 42.9 Cg_exo -54.96 -165.63 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.739 2.293 . . . . 0.0 110.643 177.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.409 ' HD2' ' CB ' ' A' ' 62' ' ' PRO . 86.8 Cg_exo -43.03 -15.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.359 1.119 0 C-N-CA 121.796 1.664 . . . . 0.0 112.199 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.62 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 0.4 OUTLIER -40.0 -83.16 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.631 177.47 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.62 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 1.6 mm-40 -107.17 -1.19 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.281 -179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -55.08 -35.59 64.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.984 0.421 . . . . 0.0 110.549 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.585 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -115.92 29.87 7.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.586 179.376 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.589 ' HB2' ' HA ' ' A' ' 65' ' ' GLU . 10.0 mm-40 -137.57 -57.44 0.69 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.544 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.4 OUTLIER -74.45 -8.44 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.902 -178.683 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -40.73 83.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.679 0.276 . . . . 0.0 111.34 -179.635 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.967 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.72 27.94 3.02 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.451 -0.88 . . . . 0.0 112.579 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -141.2 -0.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.08 -22.62 2.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.642 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.698 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -72.9 -21.29 60.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.319 178.467 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.544 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -38.29 -57.15 1.89 Allowed Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.533 -178.12 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 55.5 Cg_endo -69.76 -20.31 35.0 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.982 1.788 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.645 HD12 ' HB2' ' A' ' 53' ' ' LEU . 65.7 mt -88.75 -19.49 25.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.631 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.698 HG12 ' O ' ' A' ' 74' ' ' LEU . 13.3 mm -73.85 -38.21 49.89 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.659 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.3 mt-30 -53.84 -16.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.923 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.85 -38.47 28.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.973 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.692 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.22 -46.07 57.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.103 0.477 . . . . 0.0 110.715 -179.689 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -111.88 159.15 34.54 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.762 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.768 ' HG2' HD23 ' A' ' 85' ' ' LEU . 36.4 Cg_endo -64.49 75.86 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.264 1.976 . . . . 0.0 111.871 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.659 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.6 OUTLIER 46.52 38.91 6.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.005 -178.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.9 OUTLIER -93.83 4.27 54.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.015 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.48 62.91 1.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.178 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -96.6 -8.05 57.52 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.5 tptt -177.48 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.891 -0.655 . . . . 0.0 110.158 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.824 HG21 HG13 ' A' ' 115' ' ' VAL . 68.1 mt -79.94 -88.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.359 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.967 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -52.7 -39.98 62.51 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.522 0.201 . . . . 0.0 111.014 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.17 -29.56 52.65 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.582 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.729 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.7 ttp -76.75 -33.66 58.1 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.107 -0.547 . . . . 0.0 109.988 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.47 -5.22 0.75 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.702 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.715 HD21 HD13 ' A' ' 70' ' ' LEU . 2.1 mm? -110.3 27.33 9.73 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -170.57 3.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.018 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.913 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -150.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.338 0.59 . . . . 0.0 111.512 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.567 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.4 t70 -59.52 -3.01 0.39 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.192 177.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.575 ' H ' HG12 ' A' ' 96' ' ' ILE . 15.4 m120 78.66 -29.72 0.15 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.48 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -32.94 65.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.44 . . . . 0.0 109.938 178.136 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.913 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -74.16 -23.83 59.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.876 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.435 ' CB ' HD11 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -75.18 -24.7 57.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.892 177.168 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.2 mp -90.2 -45.02 9.37 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.324 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -37.13 82.35 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.936 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.612 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -59.61 -35.87 75.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.285 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 58' ' ' LEU . 15.5 mt -87.1 -9.07 56.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.07 0.462 . . . . 0.0 110.058 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -108.93 -5.05 16.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.399 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.855 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.7 OUTLIER -148.54 129.52 7.04 Favored Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.673 -179.411 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.18 0.48 3.24 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.849 2.366 . . . . 0.0 112.555 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -126.31 -19.93 4.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.784 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.855 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -64.03 -47.94 78.27 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.325 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.784 ' HB3' HG22 ' A' ' 54' ' ' THR . 3.8 tt -50.39 -22.86 2.04 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.769 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -94.16 -62.87 1.26 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.196 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.0 t -50.23 -29.42 9.43 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.58 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 14.2 mmtp -81.18 -43.1 19.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.666 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.824 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -64.58 -58.2 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.265 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.431 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -51.02 -41.11 59.6 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.886 0.374 . . . . 0.0 110.83 178.425 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 113' ' ' SER . 12.5 mt-10 -71.68 -32.83 68.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.219 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.74 -23.05 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.037 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.2 t -65.28 -47.97 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 109.676 176.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.55 -27.68 64.79 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.482 177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.3 t -83.54 -32.42 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.693 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.83 -41.06 65.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.173 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.484 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.3 mm100 -61.74 -36.63 81.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.017 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.51 ' C ' ' HG2' ' A' ' 128' ' ' LYS . . . -70.65 -78.4 0.08 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.595 177.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.488 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.9 OUTLIER -29.61 -39.25 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.866 0.729 . . . . 0.0 112.555 -177.761 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 124' ' ' ALA . 14.4 mm100 -61.34 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.305 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.57 28.26 3.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.791 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.6 OUTLIER -95.98 -162.71 0.98 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.235 0.54 . . . . 0.0 111.173 179.265 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -88.08 26.81 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.697 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.791 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -59.25 -76.16 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.908 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -91.99 -166.21 1.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.916 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -77.37 162.7 27.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.61 106.94 5.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.864 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.59 -164.75 1.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.039 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.0 p -73.96 -17.0 17.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -84.65 33.34 0.52 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.68 134.18 34.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.934 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.85 -172.15 0.97 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.998 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.5 t -95.78 63.83 2.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.856 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -96.08 103.98 3.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.522 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 17.9 m -83.6 140.13 41.18 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.561 0.22 . . . . 0.0 111.122 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.87 140.32 58.21 Favored 'Cis proline' 0 C--N 1.348 0.507 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.371 0.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 m -99.75 110.45 22.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.808 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.101 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 120.218 -0.212 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.55 121.45 9.99 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.704 2.27 . . . . 0.0 112.165 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.89 -33.69 26.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.925 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.11 42.71 2.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 78.9 p -81.23 -51.59 8.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.75 0.31 . . . . 0.0 110.893 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.23 87.49 2.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.081 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.13 28.31 1.71 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.108 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 163.48 9.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.68 170.05 2.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.096 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 4.9 m 60.27 100.79 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.174 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.944 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 10' ' ' THR . 72.7 Cg_endo -76.34 154.17 97.65 Favored 'Cis proline' 0 C--N 1.35 0.624 0 C-N-CA 123.538 -1.443 . . . . 0.0 112.468 0.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.32 -52.78 4.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.063 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -107.61 174.48 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.135 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -49.67 9.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.42 152.34 20.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.955 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 43.9 t -99.26 127.08 35.66 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 20.4 Cg_exo -66.39 -148.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.739 2.293 . . . . 0.0 112.139 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -70.75 150.26 46.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.746 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -59.9 139.84 57.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.065 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -162.64 0.82 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 91.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.884 0.373 . . . . 0.0 110.85 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.05 93.87 9.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.992 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.51 122.59 23.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.04 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.35 80.97 1.36 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.587 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -101.64 -13.99 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.92 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -12.09 53.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.842 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -93.82 123.06 60.78 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.861 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -60.51 92.46 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.591 2.194 . . . . 0.0 112.17 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -94.33 153.38 18.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.854 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -75.15 -177.19 3.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.97 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -140.17 31.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 33' ' ' ASN . 0.5 OUTLIER -72.82 -28.97 62.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.035 -179.734 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.436 ' N ' ' HG ' ' A' ' 32' ' ' LEU . 26.8 m120 -102.73 31.69 4.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.78 -3.56 58.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.023 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -77.82 124.42 86.31 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 153.65 77.26 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.466 2.11 . . . . 0.0 112.165 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.756 ' HB3' ' HB2' ' A' ' 40' ' ' MET . 2.2 mp0 -93.7 96.7 9.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.92 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.98 -27.26 6.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.019 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -80.69 -10.75 59.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.895 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.756 ' HB2' ' HB3' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -91.14 96.14 10.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.978 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -97.55 86.95 3.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.808 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.96 98.23 3.16 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.42 94.66 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.568 2.179 . . . . 0.0 112.287 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.68 150.32 34.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.109 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.454 HG11 ' HB1' ' A' ' 80' ' ' ALA . 14.7 m -93.24 25.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -102.14 -29.46 11.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.066 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.64 -176.94 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.075 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -95.14 38.92 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.64 -77.6 1.38 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.536 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.45 110.85 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.819 0.342 . . . . 0.0 110.915 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.71 114.09 58.46 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.893 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.14 163.33 8.06 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.626 2.218 . . . . 0.0 112.449 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.717 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -85.77 152.51 22.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.998 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.881 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.08 -175.56 4.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.186 179.019 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 1.001 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.94 -32.68 47.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.342 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.3 m -67.19 -49.05 66.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.602 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.643 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -59.22 -37.04 76.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.318 0.58 . . . . 0.0 110.154 178.754 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.001 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.3 mt -64.51 -44.31 91.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.563 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.25 -10.4 41.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.577 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -75.37 -2.92 30.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -131.39 110.39 15.07 Favored Pre-proline 0 N--CA 1.452 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.831 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.557 ' O ' ' N ' ' A' ' 64' ' ' GLN . 45.4 Cg_exo -55.62 -160.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.191 2.594 . . . . 0.0 110.891 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 62' ' ' PRO . 73.8 Cg_exo -42.56 -12.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 122.005 1.803 . . . . 0.0 113.138 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 62' ' ' PRO . 25.4 mm100 -42.7 -85.62 0.0 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.04 0.448 . . . . 0.0 110.58 176.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.762 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -107.09 -78.97 0.58 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.976 177.773 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER 56.59 -72.44 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.904 0.752 . . . . 0.0 110.658 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.641 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.94 19.52 4.82 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.319 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.762 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 3.2 mm100 -116.91 -38.44 3.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.355 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.633 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 33.5 mtm -80.76 -7.73 59.47 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.894 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -60.71 -35.64 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -178.558 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -143.01 28.26 2.13 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.096 -1.05 . . . . 0.0 112.988 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -139.27 -6.53 1.38 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.778 0.323 . . . . 0.0 111.16 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.527 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.0 tmt_? -127.68 -19.48 4.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.132 0.491 . . . . 0.0 109.898 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.59 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -77.78 -26.35 49.69 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.76 178.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.536 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -38.75 -52.71 3.57 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.316 -177.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 14.2 Cg_exo -71.17 -22.78 25.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.289 1.993 . . . . 0.0 112.819 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.717 HD12 ' HB2' ' A' ' 53' ' ' LEU . 58.4 mt -88.02 -23.17 23.87 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.765 HG13 ' HB ' ' A' ' 90' ' ' THR . 5.6 mm -72.16 -37.49 59.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 110.413 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.848 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.7 mt-30 -54.2 -14.75 1.22 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.283 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.454 ' HB1' HG11 ' A' ' 45' ' ' VAL . . . -84.12 -36.66 22.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.843 178.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.47 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.43 -35.27 68.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.015 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.694 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.2 m-70 -121.91 162.09 38.86 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 -179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.07 72.3 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.625 2.217 . . . . 0.0 111.948 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.848 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 51.11 24.76 2.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.287 -179.37 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 9.1 mt -85.39 5.15 32.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.936 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.699 ' HB3' ' HG3' ' A' ' 79' ' ' GLN . . . -83.01 47.55 1.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.259 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -91.76 12.47 69.33 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.004 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.934 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 5.1 ttpt -177.58 -13.51 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.832 HG21 HG13 ' A' ' 115' ' ' VAL . 36.7 mt -49.85 -82.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.49 -38.12 63.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.509 0.195 . . . . 0.0 110.786 -178.834 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.65 -28.85 65.95 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.48 176.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.934 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.5 ttm -75.85 -38.24 58.19 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.458 0.647 . . . . 0.0 109.885 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.674 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -54.7 -9.55 0.35 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.486 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.894 HD11 HD13 ' A' ' 70' ' ' LEU . 5.0 mp -105.74 28.55 7.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.431 ' H ' ' H ' ' A' ' 96' ' ' ILE . 9.8 pt-20 -172.43 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.407 -178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.987 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.32 -150.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.323 0.583 . . . . 0.0 111.734 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -57.72 -5.7 0.42 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.858 177.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.559 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-20 79.62 -25.63 0.18 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.236 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.4 50.78 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.987 ' HB2' HG13 ' A' ' 96' ' ' ILE . 3.9 mt-10 -76.07 -24.28 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.776 177.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.707 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -75.2 -26.03 58.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.023 177.134 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 mp -90.72 -44.95 9.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.038 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.53 -41.65 96.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.04 -178.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.787 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.0 ptm -56.75 -37.5 71.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.812 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.842 HD23 HD13 ' A' ' 58' ' ' LEU . 56.5 mt -80.44 -11.61 59.66 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.232 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -4.4 14.38 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.761 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -144.2 134.65 12.08 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.164 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.574 ' O ' HG21 ' A' ' 54' ' ' THR . 7.8 Cg_exo -72.92 3.55 4.37 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.984 2.456 . . . . 0.0 111.671 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 113' ' ' SER . 28.5 mt-10 -126.15 -14.41 6.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.656 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.761 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -76.28 -47.21 24.57 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.002 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.881 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.78 -40.4 13.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.429 176.114 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 112' ' ' ARG . 0.3 OUTLIER -81.88 -65.53 1.0 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.573 -179.44 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.513 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -47.43 -49.72 24.52 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -178.479 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.5 mmtp -64.24 -30.96 71.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.193 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.832 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.78 -56.48 10.64 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.068 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.123 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -54.91 -35.68 64.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.021 0.438 . . . . 0.0 110.408 178.034 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.97 -32.05 61.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.088 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.623 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.4 -28.99 67.58 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.835 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.694 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -59.68 -49.02 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.158 0.504 . . . . 0.0 109.787 177.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.37 -25.92 51.21 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.701 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 9.9 t -86.64 -30.77 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.846 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.719 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.09 -41.02 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.996 179.275 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.481 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 15.1 mm100 -65.27 -35.06 79.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.004 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -72.16 -76.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.52 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.714 ' HA ' ' HE3' ' A' ' 128' ' ' LYS . 0.4 OUTLIER -31.73 -35.22 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.658 0.599 . . . . 0.0 112.142 -178.614 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 124' ' ' ALA . 88.3 mm-40 -70.14 -78.71 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.113 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.73 32.34 2.1 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.747 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.1 OUTLIER -96.4 -156.41 0.53 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.117 0.484 . . . . 0.0 110.83 178.738 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -87.24 23.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.747 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.2 -28.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.181 -178.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.02 -43.64 52.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -83.26 97.44 8.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -89.5 -46.02 8.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.78 167.43 18.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.6 t -89.54 107.85 18.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.67 -18.88 65.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.82 87.97 5.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.885 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.01 122.99 30.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 138.57 42.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.869 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -79.09 -101.01 0.23 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.487 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 23.7 m -77.55 143.94 68.92 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 0.0 111.15 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.98 140.26 93.31 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.619 2.213 . . . . 0.0 112.282 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 80.8 p -93.15 -8.04 43.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.164 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.68 -37.18 22.25 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.514 2.142 . . . . 0.0 112.22 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.7 174.79 6.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.983 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.23 25.75 9.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.587 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.2 p -96.85 -25.76 15.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.301 . . . . 0.0 110.94 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.47 174.59 7.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -81.89 -164.54 0.81 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.105 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.35 53.17 9.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.134 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -144.9 -68.21 0.31 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -166.0 134.7 2.46 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.71 16.1 1.35 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.638 2.225 . . . . 0.0 112.499 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.2 63.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.235 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 m -89.84 12.04 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.139 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -96.22 89.98 5.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.858 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 p -97.14 -173.95 2.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.912 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 98.49 47.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.139 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -76.27 -41.01 0.52 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.61 2.207 . . . . 0.0 112.366 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -96.15 -173.76 2.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.066 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.61 -167.83 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.039 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.34 14.4 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.963 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -89.21 86.14 6.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.8 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.84 -64.42 1.15 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.09 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 160.56 21.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.069 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.98 -2.46 58.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.594 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.9 p -82.33 140.58 16.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 110.943 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 -81.51 -177.18 6.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.877 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 62.9 m-80 -88.09 108.83 23.64 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 27' ' ' ASN . 35.0 Cg_endo -65.25 -76.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.455 2.104 . . . . 0.0 112.359 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -89.58 115.34 26.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -97.92 178.88 4.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.011 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -123.36 27.26 7.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.815 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.68 169.53 10.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -98.26 84.68 3.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.823 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.58 35.62 1.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.67 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 43.3 mm-40 -83.29 -51.96 0.64 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.184 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.67 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 16.6 Cg_exo -67.91 -12.41 35.22 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 122.269 1.98 . . . . 0.0 112.085 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.47 107.51 19.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.019 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -98.61 132.52 43.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.3 t -85.03 136.97 33.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.997 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.9 mtp -103.47 123.16 46.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.958 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 56.35 83.08 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.057 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.89 88.32 4.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.914 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -56.25 102.73 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.618 2.212 . . . . 0.0 112.303 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.03 78.2 6.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.975 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 m -92.66 170.1 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.198 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -86.82 60.33 6.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.826 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.7 p -93.83 142.18 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.023 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -81.65 127.76 33.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -92.68 27.73 10.4 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.535 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -109.11 72.61 0.82 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.888 0.375 . . . . 0.0 110.999 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -84.24 121.83 75.44 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.851 179.886 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.23 -175.56 1.8 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.476 2.117 . . . . 0.0 112.477 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -80.74 148.17 30.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.022 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.94 -174.95 3.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.585 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.51 -31.14 14.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.61 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -67.96 -46.85 70.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.865 0.364 . . . . 0.0 110.473 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.822 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.13 -38.12 75.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.787 178.373 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.641 ' HG ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -64.71 -43.52 93.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 178.159 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.488 ' O ' ' HD3' ' A' ' 62' ' ' PRO . . . -70.89 -2.07 13.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.088 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 57' ' ' MET . 74.5 m -86.0 -8.5 57.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.886 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.659 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.69 53.03 9.28 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.74 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 1.1 Cg_endo -49.43 -49.69 14.97 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.517 2.144 . . . . 0.0 113.568 -178.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.667 ' HD3' ' HG2' ' A' ' 62' ' ' PRO . 55.2 Cg_endo -96.87 4.3 1.71 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.476 2.117 . . . . 0.0 112.81 -178.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.423 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -113.27 -97.26 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.494 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.727 ' HB2' ' HG3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.05 45.18 1.0 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.294 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.74 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 2.9 tt0 -62.08 -31.56 72.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.7 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -123.14 37.56 4.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.935 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.691 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 6.4 tt0 -128.19 -50.26 1.31 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.679 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.727 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 15.4 mtm -74.46 10.17 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 111.726 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 1.058 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.57 -62.34 1.56 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.58 0.705 . . . . 0.0 110.391 -179.562 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.012 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -114.66 16.6 18.86 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 112.393 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.54 -8.18 4.63 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -125.97 -17.56 5.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.005 0.431 . . . . 0.0 110.816 -179.582 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.646 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.09 -10.98 59.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.633 -179.37 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.473 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 10.4 t80 -49.13 -54.04 32.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.771 -178.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.511 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 44.0 Cg_endo -67.29 -13.61 40.04 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.031 1.821 . . . . 0.0 112.079 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.821 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.0 mm? -86.39 -42.63 13.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.299 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.809 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.3 mm -60.95 -40.5 85.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.851 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.3 mt-30 -47.81 -20.45 0.3 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.024 -179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.21 -42.4 15.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.852 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.485 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -68.78 -39.98 79.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.62 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.886 ' CE1' HG21 ' A' ' 119' ' ' VAL . 6.2 m170 -123.5 155.82 65.13 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.932 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.49 ' HD2' HD12 ' A' ' 85' ' ' LEU . 24.6 Cg_exo -63.21 77.22 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 0.0 111.958 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 41.36 30.06 0.12 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.719 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.49 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.7 OUTLIER -85.41 8.38 19.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.779 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.809 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.56 12.55 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.874 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -52.95 -22.22 11.96 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.049 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.724 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -161.34 26.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.907 0.384 . . . . 0.0 111.275 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.872 HG21 HG13 ' A' ' 115' ' ' VAL . 62.8 mt -80.77 -87.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.199 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.012 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.91 -39.31 58.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.224 -179.42 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.15 -31.38 61.94 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.033 -1.08 . . . . 0.0 110.632 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.724 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.9 ttp -74.9 -34.31 62.16 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.081 -0.559 . . . . 0.0 110.083 177.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.685 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -58.37 -7.12 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.249 -177.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.058 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.6 mp -111.62 29.06 8.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 176.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 11.0 pt-20 -167.99 0.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.038 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 1.006 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.73 -148.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.488 0.661 . . . . 0.0 111.382 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -57.74 -6.29 0.5 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.7 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.741 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 78.57 -31.58 0.15 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.276 -179.302 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.52 -29.69 69.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.885 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 1.006 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -74.86 -35.52 62.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.107 177.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.631 ' HG ' HD12 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -65.32 -30.04 70.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.03 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.631 HD12 ' HG ' ' A' ' 101' ' ' LEU . 5.4 mp -81.79 -47.65 12.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.352 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -43.64 92.01 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.529 -177.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.827 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -55.92 -34.16 65.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.625 -179.078 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.663 HD21 ' HB3' ' A' ' 70' ' ' LEU . 21.2 mt -86.25 -11.4 52.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.841 0.353 . . . . 0.0 110.933 -179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.24 -6.52 17.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -177.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.774 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.37 139.12 16.16 Favored Pre-proline 0 C--N 1.332 -0.184 0 C-N-CA 120.454 -0.498 . . . . 0.0 112.153 -178.78 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.573 ' O ' HG21 ' A' ' 54' ' ' THR . 72.1 Cg_endo -75.78 2.81 6.6 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.606 2.204 . . . . 0.0 111.778 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -125.52 -12.95 6.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.345 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.69 -46.22 19.57 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 177.585 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.46 -40.62 18.69 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.393 176.149 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -79.32 -61.42 2.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.359 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 28.7 t -50.21 -53.13 30.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -178.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 3.7 mmtp -60.11 -29.8 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.373 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.872 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -72.91 -62.14 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.092 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 7.7 t0 -49.23 -35.12 16.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.995 0.426 . . . . 0.0 110.749 178.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -43.53 61.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.448 178.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.31 65.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.998 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.886 HG21 ' CE1' ' A' ' 82' ' ' HIS . 57.9 t -65.35 -45.88 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.688 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.87 -27.34 65.08 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.428 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.499 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 22.4 t -83.07 -33.2 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.477 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.448 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.41 -38.95 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.959 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -67.48 -28.69 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.019 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.92 -8.85 53.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.204 179.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.703 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.1 OUTLIER -121.68 8.5 10.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.751 -178.825 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.434 ' HB3' ' H ' ' A' ' 127' ' ' ALA . 4.9 mm-40 -74.17 -109.91 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.417 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.434 ' H ' ' HB3' ' A' ' 126' ' ' GLN . . . -95.55 33.24 1.65 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 110.905 179.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.09 -143.0 0.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.025 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.27 15.43 4.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.106 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.703 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -62.99 -37.56 87.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -74.79 127.15 32.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -77.0 95.16 4.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.971 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -82.56 -13.4 56.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.898 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.26 157.32 37.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.032 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 21.4 m -79.09 -170.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -68.16 90.45 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.907 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.6 m -103.5 91.58 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.009 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -76.44 82.17 3.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.981 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.67 92.8 9.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.56 -62.42 1.04 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.41 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.804 ' H ' ' HA ' ' A' ' 142' ' ' PRO . 17.2 t -95.6 -47.93 0.26 Allowed Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.804 ' HA ' ' H ' ' A' ' 141' ' ' VAL . 93.6 Cg_endo -88.97 -46.78 0.17 OUTLIER 'Cis proline' 0 C--N 1.356 0.961 0 C-N-CA 124.566 -1.014 . . . . 0.0 112.857 1.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.8 p -102.65 168.08 9.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.209 -0.9 . . . . 0.0 111.022 -179.975 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.158 0 N-CA-C 112.442 -0.263 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -56.53 -29.07 77.04 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.585 2.19 . . . . 0.0 112.304 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tp -97.05 125.92 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.874 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.18 152.73 24.74 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.62 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -98.14 101.45 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.767 0.318 . . . . 0.0 110.833 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.22 76.15 0.31 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.088 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.42 101.9 11.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.263 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.42 -161.08 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.17 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.32 53.85 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.117 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.7 m -145.99 127.19 7.43 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.807 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.35 -177.74 20.89 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.362 0.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.63 -18.4 54.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.141 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -93.06 137.19 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.188 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -99.83 -26.45 14.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.798 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t -106.07 69.97 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.866 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.4 p -99.39 130.7 26.42 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.87 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.5 111.55 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.499 2.133 . . . . 0.0 112.25 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -83.17 126.07 32.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -72.92 -175.84 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.917 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -88.99 23.86 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.912 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -88.69 -31.15 18.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.955 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.88 14.77 24.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.05 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.43 109.57 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.38 25.02 28.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.03 55.45 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.958 0.409 . . . . 0.0 111.114 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.02 -34.79 50.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.894 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -80.46 151.54 72.03 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.043 -179.62 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.451 ' O ' ' HA ' ' A' ' 27' ' ' ASN . 3.0 Cg_exo -76.23 -77.13 0.0 OUTLIER 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.868 -1.305 . . . . 0.0 112.281 0.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -94.44 -106.56 0.13 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.694 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -100.43 161.15 13.79 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.705 0.288 . . . . 0.0 110.875 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -87.72 8.92 23.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.921 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.27 143.53 36.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.954 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -93.74 133.96 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.987 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.75 28.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.994 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -98.67 104.17 23.02 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.854 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.08 -18.78 18.28 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.519 2.146 . . . . 0.0 112.331 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.24 172.22 13.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.799 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -101.56 95.13 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.098 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.44 82.23 2.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.939 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.31 94.0 6.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.852 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.72 129.63 35.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.093 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -155.21 97.85 2.4 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.57 94.58 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.596 2.197 . . . . 0.0 112.272 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -89.02 58.2 4.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.8 t -81.91 -56.26 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.342 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.64 170.31 9.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.99 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.72 103.72 13.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.923 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -91.89 -85.79 0.24 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.35 120.63 6.57 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.579 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.475 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -94.39 172.79 7.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.796 0.331 . . . . 0.0 110.707 179.742 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -91.07 105.69 13.3 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 96.1 Cg_endo -80.64 170.87 15.23 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.569 2.179 . . . . 0.0 112.247 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.723 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -97.58 148.91 22.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.789 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.69 -163.29 0.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.451 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -57.84 -40.24 79.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.447 -179.01 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 63.2 m -58.69 -45.69 88.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.871 0.367 . . . . 0.0 110.533 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.723 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.83 -42.2 97.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.28 178.687 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -58.21 -47.29 83.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.57 178.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.67 -10.35 51.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.326 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 57' ' ' MET . 41.5 t -82.45 -7.1 59.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.022 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.856 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -134.34 55.96 16.72 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.58 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.506 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 52.7 Cg_exo -55.19 -50.15 14.01 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.423 2.082 . . . . 0.0 113.288 -179.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.505 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.5 Cg_endo -87.45 -7.63 6.63 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 122.209 1.94 . . . . 0.0 112.715 -179.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.856 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 3.8 tp-100 -95.41 -83.56 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.655 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -104.92 -87.31 0.45 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.206 -179.292 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.473 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 1.6 mt-30 73.09 -62.64 0.46 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.513 -178.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -111.8 24.06 13.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.86 178.827 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.655 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 1.6 mt-30 -118.62 -53.88 2.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.357 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.574 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 4.4 ptt? -81.08 3.82 22.0 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.843 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.21 -42.44 93.5 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.048 179.7 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.042 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.22 34.48 2.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.327 -0.939 . . . . 0.0 112.83 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.51 -3.43 0.72 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.959 0.409 . . . . 0.0 111.196 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.454 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -128.48 -21.56 3.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.117 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.59 -18.71 58.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.365 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -44.61 -56.14 9.0 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.97 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 60.0 Cg_endo -71.76 -8.96 24.1 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.054 1.836 . . . . 0.0 112.092 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.516 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 73.2 mt -97.34 -24.32 15.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.397 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -69.56 -36.91 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 177.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.5 mt-30 -51.6 -15.63 0.49 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.364 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -81.77 -42.61 19.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.611 178.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.697 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.75 -30.63 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.374 179.21 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.676 ' CE1' HG21 ' A' ' 119' ' ' VAL . 15.1 m170 -124.73 156.89 67.67 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.848 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.523 ' HD2' HD12 ' A' ' 85' ' ' LEU . 12.4 Cg_exo -67.7 73.86 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.297 1.998 . . . . 0.0 110.465 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.845 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.3 t 45.0 34.06 1.17 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.112 -177.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.523 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -84.73 2.6 41.25 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.329 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -77.07 60.89 1.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.81 -8.94 61.58 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 177.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.694 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.4 ttpt -176.49 30.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.14 -0.53 . . . . 0.0 110.54 179.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.813 HG21 HG13 ' A' ' 115' ' ' VAL . 64.2 mt -80.2 -90.81 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.323 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.042 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.48 -42.8 55.1 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.122 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.06 -32.7 50.13 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.304 -0.95 . . . . 0.0 111.137 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.725 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.08 -21.32 29.39 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 120.812 0.339 . . . . 0.0 110.405 179.175 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.659 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.0 mm? -61.48 -6.41 2.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.953 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.843 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -104.56 24.8 11.12 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.038 176.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.6 pt-20 -165.85 0.7 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.559 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.915 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.5 -153.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.519 0.676 . . . . 0.0 111.93 -179.593 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 96' ' ' ILE . 2.2 t70 -58.98 -3.92 0.41 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.17 177.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.84 -35.06 0.14 Allowed 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.156 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -66.14 -26.91 67.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.915 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -83.4 -24.68 31.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.503 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.2 tm? -74.86 -26.25 59.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.546 176.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.8 mp -88.75 -46.1 9.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.422 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -68.02 -36.25 79.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.644 -177.866 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.668 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 7.0 ptm -60.8 -34.92 75.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 110.941 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD23 ' A' ' 70' ' ' LEU . 27.5 mt -84.32 -13.77 51.51 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.799 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.67 -10.67 16.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.849 -177.75 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.829 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -139.37 131.88 15.33 Favored Pre-proline 0 C--N 1.33 -0.258 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.969 -178.665 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.597 ' O ' HG21 ' A' ' 54' ' ' THR . 7.1 Cg_exo -73.35 7.81 2.06 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.976 2.45 . . . . 0.0 111.859 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -127.59 -27.65 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.254 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.829 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.47 -49.26 74.34 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.789 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.8 tt -50.43 -32.9 19.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.31 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -59.32 2.34 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.379 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -57.28 -34.15 68.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.815 0.341 . . . . 0.0 111.175 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 20.0 mmtt -78.76 -29.2 45.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.354 179.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.813 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.46 -53.14 23.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.042 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.41 ' N ' HG12 ' A' ' 115' ' ' VAL . 22.8 t0 -56.85 -36.21 69.75 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.944 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -34.76 60.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.901 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.725 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -63.69 -29.94 71.1 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.446 177.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.676 HG21 ' CE1' ' A' ' 82' ' ' HIS . 23.6 t -55.46 -57.34 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.795 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.426 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -52.25 -24.51 7.44 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.416 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.518 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 10.7 t -87.02 -31.93 6.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.715 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.552 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -71.7 -43.12 66.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.918 178.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.552 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -67.06 -31.44 71.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.107 178.879 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.766 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -81.75 -12.16 58.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.205 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -119.26 8.12 11.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.247 -179.254 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -83.78 -99.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.955 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.61 23.62 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.604 0.24 . . . . 0.0 111.508 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.766 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 0.2 OUTLIER -86.62 -149.33 0.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.341 . . . . 0.0 111.185 -179.604 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -78.95 -3.79 46.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.704 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.6 -42.13 98.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.943 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -86.05 -13.54 47.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.79 -164.69 1.21 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.58 160.45 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.952 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -81.92 -53.5 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 4.8 m -93.95 128.44 45.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.011 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.78 -4.77 52.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.902 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.0 p -78.72 155.84 29.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.11 97.84 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.019 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 1.8 m -88.34 154.85 20.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.973 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -104.55 77.47 0.27 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.442 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 16.1 m -87.19 152.85 53.51 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.601 0.238 . . . . 0.0 111.014 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -62.65 174.23 3.04 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.562 2.175 . . . . 0.0 112.323 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 40.6 p -82.29 113.89 20.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.965 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.087 179.81 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.11 -22.21 54.75 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.588 2.192 . . . . 0.0 112.354 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.67 112.73 24.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.39 -8.59 57.43 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.602 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -104.96 128.83 53.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.933 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -114.13 91.93 3.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.111 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.29 170.5 8.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.062 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.46 158.84 30.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.071 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.87 170.05 10.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.6 p -71.5 138.98 83.67 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.054 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -79.22 154.09 89.68 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.504 -1.457 . . . . 0.0 112.395 -0.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.56 35.91 0.89 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.984 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 13.4 p -81.89 -22.15 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.065 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.41 116.25 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.9 p -111.74 131.66 55.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.874 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.403 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 3.4 p -98.64 130.56 27.64 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 31.3 Cg_exo -59.85 176.58 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.551 2.168 . . . . 0.0 112.276 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.26 135.53 33.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.945 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -73.67 -12.45 60.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.1 mttm -82.02 174.73 10.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -16.86 64.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.965 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.09 80.62 6.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.028 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.41 106.25 2.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.12 33.03 4.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.416 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 p -87.02 3.24 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.993 0.425 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -84.57 44.62 1.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.975 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -71.85 140.81 83.92 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.898 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.99 24.81 0.62 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.609 2.206 . . . . 0.0 112.497 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.15 32.29 0.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.976 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -76.89 -75.94 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.963 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.79 -18.6 6.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.007 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.59 122.25 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.871 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -82.71 143.66 30.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.009 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.82 1.86 37.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.86 113.5 50.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.848 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.74 156.8 56.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.38 2.053 . . . . 0.0 112.442 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -80.29 172.64 13.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.06 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.43 HG22 ' HB2' ' A' ' 40' ' ' MET . 7.0 p -86.2 135.6 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.878 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.45 44.43 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.43 ' HB2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.46 -168.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.951 -179.892 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.0 93.85 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.84 83.92 0.22 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.21 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.96 124.57 14.71 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.524 2.149 . . . . 0.0 112.155 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 134.44 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.036 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 45' ' ' VAL . 5.5 p -98.16 78.15 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.293 0.568 . . . . 0.0 110.964 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -109.89 -56.01 2.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.694 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.619 HG22 ' H ' ' A' ' 49' ' ' GLY . 11.6 p -106.06 146.32 12.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -29.23 54.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.104 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.619 ' H ' HG22 ' A' ' 47' ' ' VAL . . . -100.58 95.26 1.4 Allowed Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.567 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.508 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.5 mt-30 -94.62 96.33 9.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -91.13 105.06 11.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.902 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 83.0 Cg_endo -80.88 -117.6 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.642 2.228 . . . . 0.0 112.295 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -69.09 135.34 50.62 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.881 0.372 . . . . 0.0 110.951 -179.852 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -170.96 -177.14 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.968 178.308 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 1.014 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.84 -34.43 27.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -48.36 64.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.917 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.469 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -57.89 -41.12 81.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.194 0.521 . . . . 0.0 110.043 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.014 HD12 ' HA ' ' A' ' 55' ' ' ALA . 6.6 mt -63.91 -44.44 92.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.595 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 62' ' ' PRO . . . -62.96 -9.84 11.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.002 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.7 m -84.15 -8.84 58.97 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.999 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.77 54.01 11.58 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.506 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.611 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 60.3 Cg_endo -102.89 120.65 0.06 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.106 2.537 . . . . 0.0 113.064 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 81.5 Cg_endo -98.62 32.33 10.58 Favored 'Cis proline' 0 N--CA 1.455 -0.761 0 C-N-CA 124.459 -1.059 . . . . 0.0 112.064 -0.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.637 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 2.9 tm0? -54.17 -89.54 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.462 -178.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.882 ' HG3' ' HG2' ' A' ' 69' ' ' MET . 1.8 pt-20 -107.81 20.07 19.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.748 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -53.06 -52.85 57.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.101 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -99.26 34.91 2.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.1 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 49.4 mm-40 -133.17 -49.84 0.87 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.145 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.882 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -79.49 -7.73 58.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.909 -178.652 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.885 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -60.95 -34.56 74.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.658 0.266 . . . . 0.0 111.477 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.98 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -138.61 28.69 2.64 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.798 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -137.62 -7.31 1.7 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.866 0.365 . . . . 0.0 111.139 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -19.98 4.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.217 0.532 . . . . 0.0 109.837 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.664 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.44 -31.41 48.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.65 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.526 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.27 -53.49 5.23 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.142 -177.355 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 42.9 Cg_endo -68.21 -21.42 42.0 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.951 1.768 . . . . 0.0 112.138 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.485 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 92.0 mt -88.61 -19.76 25.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.316 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.736 HG13 ' HB ' ' A' ' 90' ' ' THR . 20.8 mm -71.73 -35.99 57.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.91 0.386 . . . . 0.0 110.135 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.487 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.1 OUTLIER -53.35 -17.15 1.66 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.424 0.63 . . . . 0.0 109.895 177.548 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.08 -38.57 27.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.621 178.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.482 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -69.8 -42.14 74.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.586 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.786 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.5 m-70 -122.25 152.0 59.89 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.953 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.652 ' HG2' HD12 ' A' ' 85' ' ' LEU . 19.8 Cg_endo -57.45 82.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.358 2.038 . . . . 0.0 111.565 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 14.1 t 40.16 37.63 0.42 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.416 -178.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -91.54 7.4 41.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.02 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.84 44.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.586 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.43 -11.64 84.94 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.536 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.639 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -175.57 32.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.851 HG21 HG13 ' A' ' 115' ' ' VAL . 70.7 mt -80.49 -89.44 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.026 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.98 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.17 -42.18 50.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.258 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.45 -31.44 57.12 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.078 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.639 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.96 -23.51 31.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 115.561 -0.319 . . . . 0.0 110.145 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.703 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -60.7 -9.06 3.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.403 178.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.885 HD11 HD13 ' A' ' 70' ' ' LEU . 4.8 mp -105.1 26.51 9.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.585 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 4.8 pt-20 -167.79 1.11 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.3 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.957 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.82 -154.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.486 0.66 . . . . 0.0 111.792 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.421 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.3 t0 -59.54 -2.82 0.38 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.201 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.537 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.79 -35.25 0.17 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.127 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -67.02 -25.82 66.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.89 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.957 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.9 mt-10 -84.18 -24.08 30.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.631 177.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.651 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.4 tp -74.82 -27.21 60.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.388 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -88.1 -47.86 8.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.091 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -63.81 -40.9 97.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.53 -178.586 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.816 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.7 ptm -56.4 -39.03 72.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.562 0.22 . . . . 0.0 111.218 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.765 HD23 HD13 ' A' ' 58' ' ' LEU . 4.5 mt -85.82 -7.55 58.66 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.167 0.508 . . . . 0.0 110.284 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -109.38 -6.51 15.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.966 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.717 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -147.06 129.79 7.87 Favored Pre-proline 0 C--N 1.328 -0.348 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.691 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.9 Cg_exo -67.78 1.32 3.35 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.78 2.32 . . . . 0.0 112.055 179.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.4 -11.22 6.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.527 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.717 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.92 -45.51 23.85 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.172 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.2 OUTLIER -46.59 -41.12 14.03 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.614 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.482 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 2.4 ttt180 -79.29 -62.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.306 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.4 t -49.74 -54.34 19.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.342 . . . . 0.0 111.221 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.793 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.2 mmtt -58.88 -29.84 67.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.338 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.851 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -73.92 -55.45 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.076 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.46 -33.15 63.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.059 0.457 . . . . 0.0 110.594 178.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -39.24 50.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.551 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.37 66.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.821 177.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.786 HG11 ' ND1' ' A' ' 82' ' ' HIS . 15.6 t -66.82 -50.96 60.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.926 177.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.26 -24.96 58.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.655 177.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.57 -32.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.635 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.35 -36.61 60.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.077 179.331 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.78 -39.44 94.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -64.54 -79.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.41 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.817 ' HA ' ' HE3' ' A' ' 128' ' ' LYS . 1.6 t60 -33.16 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.72 0.638 . . . . 0.0 112.122 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 124' ' ' ALA . 11.5 mt-30 -73.74 -76.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.212 178.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.38 30.92 2.37 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.817 ' HE3' ' HA ' ' A' ' 125' ' ' HIS . 0.0 OUTLIER -96.49 -156.15 0.51 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.152 0.501 . . . . 0.0 110.838 178.703 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.31 21.24 2.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.23 176.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.71 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.44 -51.8 68.33 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.311 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -85.9 -162.61 0.76 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.086 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.5 -79.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.001 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -89.41 175.88 7.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.007 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.84 -28.17 65.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.003 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 5.0 t -76.88 147.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -82.08 148.16 28.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.9 t -99.85 161.57 13.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.795 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.612 ' HB3' HG13 ' A' ' 141' ' ' VAL . . . -70.98 -166.52 0.16 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.075 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.6 p -87.07 -72.01 0.53 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -89.63 72.22 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.365 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.612 HG13 ' HB3' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -95.62 104.82 17.32 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.552 0.215 . . . . 0.0 111.087 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -79.22 133.22 10.75 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 0.0 112.363 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 13.1 t -100.37 -15.58 17.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.716 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.006 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.122 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.36 137.9 31.8 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.58 2.187 . . . . 0.0 112.277 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.65 -23.02 16.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.44 75.12 2.35 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.496 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.5 m -85.86 80.78 8.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -128.92 179.61 5.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.022 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -92.03 89.11 6.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -164.39 105.69 0.87 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -151.79 -20.66 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.089 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.768 ' H ' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -154.3 -53.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.514 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.768 ' HD2' ' H ' ' A' ' 10' ' ' THR . 39.5 Cg_endo -66.02 -38.56 21.9 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.129 1.886 . . . . 0.0 112.161 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.5 69.28 9.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.052 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.739 HG22 ' H ' ' A' ' 15' ' ' THR . 11.7 p -82.56 147.9 5.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.048 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.4 ptt-85 -90.43 6.19 44.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.072 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.739 ' H ' HG22 ' A' ' 13' ' ' VAL . 17.1 p -102.81 159.97 15.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.936 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.59 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 7.0 t -98.39 -52.17 0.21 Allowed Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.634 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.59 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 60.9 Cg_endo -72.45 131.63 17.86 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.093 1.862 . . . . 0.0 112.391 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -82.96 162.53 21.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.964 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.32 -89.46 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.86 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 20' ' ' LYS . 2.7 ptmt -72.54 121.19 19.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.833 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -79.99 163.5 24.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.36 -55.83 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.23 124.18 27.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.018 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -21.33 64.64 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.57 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.7 t -106.13 135.24 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.117 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -95.82 160.83 14.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.24 144.42 92.27 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.921 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -66.96 91.2 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.543 2.162 . . . . 0.0 112.308 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -99.66 24.15 8.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.005 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -86.56 -91.06 0.1 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.902 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -169.37 -34.14 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.038 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 pp -69.62 155.78 39.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.993 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -98.17 86.5 3.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.63 90.99 6.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.045 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.53 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 29.0 mm100 -81.49 -51.35 0.87 Allowed Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.312 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 96.7 Cg_endo -79.49 68.34 8.32 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.178 1.919 . . . . 0.0 112.414 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -93.24 24.32 3.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.846 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.6 m -81.07 -18.04 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.014 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.1 117.91 22.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.968 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.85 -178.45 3.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.35 131.77 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 54.92 71.0 1.4 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.067 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.69 83.35 1.57 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.493 2.128 . . . . 0.0 112.352 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.23 108.89 2.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.811 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.6 m -92.95 133.28 34.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -92.3 30.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.646 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.0 p -90.14 148.16 4.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.194 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -71.55 -165.69 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -74.42 -20.51 79.58 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.54 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -89.97 113.1 24.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 110.947 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.551 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -82.17 -50.27 0.83 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 37.9 Cg_endo -66.46 147.93 83.2 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.03 1.82 . . . . 0.0 112.491 -179.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.855 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -76.65 138.39 40.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.591 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.872 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.88 179.14 5.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.709 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.582 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -48.39 -40.23 25.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.524 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.681 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 70.7 m -58.55 -47.96 82.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.975 0.417 . . . . 0.0 110.538 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.681 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.14 -42.93 86.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.179 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -59.64 -45.33 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.809 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.92 -12.16 34.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.338 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 m -76.46 -11.41 59.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.313 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.898 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . . . -139.14 61.01 18.96 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.406 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 63' ' ' PRO . 71.2 Cg_endo -100.47 124.03 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.217 2.612 . . . . 0.0 112.813 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 71.2 Cg_endo -98.03 30.76 12.73 Favored 'Cis proline' 0 N--CA 1.456 -0.698 0 C-N-CA 124.365 -1.098 . . . . 0.0 112.218 -0.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.852 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 46.9 mm-40 -52.78 -85.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.574 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 1.015 ' HG3' ' HG2' ' A' ' 69' ' ' MET . 6.7 pt-20 -106.63 28.37 7.94 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.171 0.51 . . . . 0.0 110.583 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -68.09 -18.51 64.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.348 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.656 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.89 28.79 4.49 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.714 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -131.92 -58.76 0.96 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.077 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . 1.015 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -80.7 24.13 0.49 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -87.84 -42.61 12.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.39 0.614 . . . . 0.0 109.717 178.749 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.054 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -118.77 11.93 11.98 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.057 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -125.67 3.1 7.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.735 -0.232 . . . . 0.0 111.517 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.741 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.16 -33.02 2.68 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.957 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.855 HD22 HD12 ' A' ' 53' ' ' LEU . 2.6 mm? -56.84 -32.8 66.13 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.88 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 4.8 t80 -34.13 -62.58 0.37 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -173.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.88 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.9 Cg_exo -64.25 -17.96 61.58 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.906 1.737 . . . . 0.0 112.281 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.709 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.1 mt -98.53 -18.62 18.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.901 -0.591 . . . . 0.0 112.276 -177.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 8.7 mm -72.73 -46.44 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.937 0.399 . . . . 0.0 110.492 179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.678 ' HG2' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -52.65 -17.34 1.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.178 178.5 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.61 -37.41 36.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.712 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.31 -49.27 23.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.813 -179.321 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.695 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.9 m-70 -107.72 159.39 30.54 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.418 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.651 ' HD2' HD12 ' A' ' 85' ' ' LEU . 19.9 Cg_exo -65.39 72.17 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.524 2.15 . . . . 0.0 111.904 179.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.678 HG23 ' HG2' ' A' ' 79' ' ' GLN . 1.6 m 49.03 39.44 14.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.933 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.651 HD12 ' HD2' ' A' ' 83' ' ' PRO . 14.9 mt -95.83 9.15 41.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.276 -179.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.604 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.11 -140.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.718 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.511 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.27 -12.66 30.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.581 -0.819 . . . . 0.0 111.897 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.757 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -156.63 -23.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.786 HG21 HG13 ' A' ' 115' ' ' VAL . 56.9 mt -50.33 -84.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.227 -0.115 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.054 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -55.34 -36.84 66.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.674 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.03 -29.23 59.16 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.595 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.4 ttp -76.45 -35.65 58.36 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.019 -0.591 . . . . 0.0 109.672 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.732 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.6 mm? -58.62 -6.93 0.81 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.72 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.684 ' HA ' HD12 ' A' ' 101' ' ' LEU . 1.3 mm? -108.14 27.17 9.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.4 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -170.78 3.21 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.334 -178.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.896 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -151.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.346 0.593 . . . . 0.0 111.691 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.57 -2.59 0.36 Allowed 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.092 177.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 71.1 m-20 78.16 -27.84 0.16 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.377 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -31.5 60.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.001 0.429 . . . . 0.0 110.008 178.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.896 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.1 mt-10 -75.32 -23.71 57.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.786 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.805 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.04 -23.63 58.15 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.862 177.06 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.805 HD12 HD23 ' A' ' 101' ' ' LEU . 2.4 mp -92.47 -42.45 9.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.266 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.53 -39.55 85.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.273 -178.67 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.846 ' HB2' HD22 ' A' ' 111' ' ' LEU . 6.3 ptm -57.68 -33.61 68.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD13 ' A' ' 70' ' ' LEU . 12.6 mt -87.15 -10.54 52.46 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.917 -179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.93 -8.1 14.52 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -177.317 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.694 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -139.9 132.64 15.04 Favored Pre-proline 0 C--N 1.33 -0.263 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.883 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 61.1 Cg_endo -72.03 4.56 3.15 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.663 2.242 . . . . 0.0 112.03 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 113' ' ' SER . 65.4 mt-10 -127.3 -13.09 5.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.494 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.694 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.51 -46.91 20.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.038 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.872 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.93 -40.7 14.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -66.1 0.93 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 3.9 m -47.06 -47.7 22.58 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.737 0.304 . . . . 0.0 111.429 -178.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 9.4 mmtt -64.69 -33.47 76.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.786 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -69.16 -55.05 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.3 t70 -54.04 -38.16 64.91 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.95 0.405 . . . . 0.0 110.456 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -75.2 -31.19 60.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.128 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.77 -21.21 62.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.946 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.695 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -67.77 -48.78 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.581 0 N-CA-C 109.479 -0.564 . . . . 0.0 109.479 176.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.6 -22.65 56.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.101 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 43.1 t -86.46 -33.99 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.46 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.757 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.97 -38.68 72.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.606 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -69.67 -28.85 66.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.907 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.696 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -88.7 -6.36 57.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.97 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 2.5 t-80 -115.59 -5.53 12.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.288 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 122' ' ' LEU . 6.6 mm100 -69.04 -104.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.953 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.33 31.16 2.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.693 0.283 . . . . 0.0 111.105 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.696 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 1.5 mttm -93.5 -157.02 0.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.261 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.66 24.08 1.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.727 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.483 ' CB ' ' HA ' ' A' ' 125' ' ' HIS . . . -86.73 36.8 0.72 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.307 -179.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.68 -10.76 49.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -88.78 164.64 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.859 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -22.59 21.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.999 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -81.99 134.49 35.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.101 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.7 m -104.33 133.88 47.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.079 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -92.55 159.87 15.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.95 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 3.4 t -99.4 -73.72 0.62 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.951 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -79.23 154.73 28.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.5 t -97.94 -35.68 10.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -91.03 56.99 3.28 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.479 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.607 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 3.9 t -96.06 -51.97 0.23 Allowed Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.431 0.16 . . . . 0.0 111.431 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.607 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 22.9 Cg_exo -65.27 -177.0 0.56 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.32 2.013 . . . . 0.0 112.183 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 p -83.69 68.94 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.074 -179.922 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 112.401 -0.28 . . . . 0.0 112.401 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -61.29 162.26 20.76 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.585 2.19 . . . . 0.0 112.201 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.88 146.47 26.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -97.3 136.87 12.99 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.393 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 147.4 24.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.773 0.32 . . . . 0.0 110.911 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.42 60.14 3.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.04 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.23 11.33 21.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -156.69 40.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.933 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 61.16 179.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.182 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.411 ' HA ' ' C ' ' A' ' 11' ' ' PRO . 23.6 p -135.13 135.39 22.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.828 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.411 ' C ' ' HA ' ' A' ' 10' ' ' THR . 12.7 Cg_exo -70.73 141.9 70.22 Favored 'Cis proline' 0 C--N 1.349 0.563 0 C-N-CA 123.847 -1.314 . . . . 0.0 112.416 0.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.22 -21.11 46.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.24 133.59 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.951 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.422 ' HD3' HH11 ' A' ' 14' ' ' ARG . 21.8 mtp180 -86.56 -60.01 2.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.966 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.48 126.49 45.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.074 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.0 t -115.93 115.61 40.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.78 113.12 1.28 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.55 2.167 . . . . 0.0 112.277 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.22 -164.08 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.851 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -60.69 123.66 18.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.79 179.74 6.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.77 55.84 3.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.63 85.45 6.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.032 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.67 10.51 15.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.108 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.71 -66.46 1.67 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.363 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.3 p -105.8 126.51 61.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.919 0.39 . . . . 0.0 110.901 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 100.11 11.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.873 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.71 106.61 41.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.21 -70.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.549 2.166 . . . . 0.0 112.269 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -88.52 64.3 7.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -76.73 -72.48 0.34 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -156.93 -5.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.87 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 tp -72.49 113.79 9.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.73 -22.61 15.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.26 110.78 18.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.45 122.85 70.46 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.941 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.37 -154.3 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.449 2.099 . . . . 0.0 112.143 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -79.87 116.49 20.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.4 m -79.26 -13.79 13.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.972 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.97 127.03 33.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.887 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.13 140.57 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.486 ' H ' ' HG2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -106.59 125.44 51.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.822 179.799 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.451 ' HB2' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -64.4 -51.83 57.75 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.464 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.451 ' HD3' ' HB2' ' A' ' 42' ' ' GLN . 19.9 Cg_exo -66.28 -169.6 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.19 1.927 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.94 175.34 3.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.996 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 p -101.53 -29.89 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -101.03 -173.51 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.662 ' HB ' ' HB2' ' A' ' 50' ' ' GLN . 2.9 t -94.01 146.22 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.085 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.87 -26.62 23.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.963 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.491 ' H ' HG12 ' A' ' 47' ' ' VAL . . . -94.51 -18.2 36.48 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.623 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.662 ' HB2' ' HB ' ' A' ' 47' ' ' VAL . 11.9 mt-30 -102.31 52.75 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.871 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -70.66 127.89 91.49 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.839 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.58 -175.12 1.24 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.503 2.136 . . . . 0.0 112.31 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.754 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -91.01 148.38 22.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.015 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.844 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.56 -165.5 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.2 179.321 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -55.93 -38.21 69.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -60.09 -47.19 86.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.51 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.754 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.17 -43.78 87.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.178 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -57.24 -48.68 78.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.545 178.972 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.14 -3.58 20.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.447 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 36.2 t -88.26 -7.48 56.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.62 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -135.43 53.67 9.12 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.665 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.62 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 80.9 Cg_endo -103.69 114.09 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.148 2.566 . . . . 0.0 113.227 -178.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.524 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 91.6 Cg_endo -100.25 133.26 2.11 Favored 'Cis proline' 0 N--CA 1.456 -0.714 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.381 -0.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.501 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.6 OUTLIER -174.63 -85.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 179.793 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.722 ' HB3' ' HG2' ' A' ' 69' ' ' MET . 5.7 mm-40 -94.23 -0.93 54.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.959 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -52.99 -49.73 65.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.222 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.431 ' H ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -105.26 36.51 2.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.51 178.507 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.697 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 5.9 tp60 -136.06 -63.56 0.64 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.032 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.722 ' HG2' ' HB3' ' A' ' 65' ' ' GLU . 3.3 ptt? -81.44 22.53 0.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.942 ' H ' HD23 ' A' ' 70' ' ' LEU . 1.2 pt? -79.83 -43.47 22.32 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.889 -0.325 . . . . 0.0 111.18 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.008 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -140.49 31.84 2.2 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.331 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -140.66 -7.83 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.653 0.263 . . . . 0.0 111.241 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.27 -14.36 5.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.596 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -75.48 -15.61 60.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.212 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.676 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -47.29 -56.27 13.05 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.781 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.676 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 34.8 Cg_exo -60.35 -11.94 18.38 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.04 1.826 . . . . 0.0 112.272 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.588 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.7 mm? -98.47 -29.05 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.65 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.759 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.2 mm -65.47 -38.11 81.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 120.773 0.321 . . . . 0.0 111.185 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.941 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 20.2 mt-30 -52.02 -17.72 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.578 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.7 -37.25 22.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.276 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.759 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.24 -35.72 61.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.068 0.461 . . . . 0.0 110.682 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.791 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -126.08 155.84 72.86 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.696 -179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.558 ' HD2' HD12 ' A' ' 85' ' ' LEU . 25.1 Cg_exo -62.37 74.32 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.493 2.129 . . . . 0.0 111.854 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.941 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.2 p 48.37 31.4 2.72 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.987 -178.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -83.67 4.97 26.26 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.17 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.66 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.89 -138.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.878 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.24 -16.4 23.41 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.667 -0.777 . . . . 0.0 111.683 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.889 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.7 ttpt -156.02 -20.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.84 HG21 HG13 ' A' ' 115' ' ' VAL . 60.0 mt -50.35 -81.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.008 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.27 -39.79 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.513 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.96 -28.11 60.43 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 176.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.889 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.6 ttm -76.71 -38.1 54.94 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.41 0.624 . . . . 0.0 109.617 176.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -57.85 -5.82 0.46 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.334 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.862 HD21 ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.6 27.37 9.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.569 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.461 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -170.14 1.29 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.211 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.945 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.18 -152.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.402 0.62 . . . . 0.0 111.654 -179.793 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 96' ' ' ILE . 1.8 t70 -59.58 -3.22 0.44 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.058 177.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.608 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.15 -34.91 0.16 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 123.733 0.645 . . . . 0.0 111.234 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -29.18 68.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.938 178.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.945 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -79.67 -26.23 41.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.802 177.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.561 HD12 HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -74.82 -27.17 60.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.618 176.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.88 -46.87 10.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.301 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.9 -39.94 87.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.118 -178.648 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.776 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -56.52 -34.13 66.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.521 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 23.0 mt -85.67 -12.98 49.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.506 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -107.8 -2.05 20.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.37 -177.323 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.808 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -150.07 132.64 8.14 Favored Pre-proline 0 CA--C 1.53 0.207 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 54' ' ' THR . 16.6 Cg_exo -68.48 -1.66 7.8 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.933 2.422 . . . . 0.0 112.139 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -116.96 -29.38 6.01 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.057 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.808 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -62.11 -42.19 98.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.203 -178.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.844 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.8 tt -59.77 -25.39 64.86 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.669 -0.413 . . . . 0.0 111.176 179.303 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.7 mtp180 -95.92 -66.09 0.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.923 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.53 ' HG ' ' HG3' ' A' ' 109' ' ' GLU . 1.5 m -42.82 -33.99 0.86 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.961 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 38.7 mmtt -81.77 -43.26 18.6 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.144 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.84 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.19 -58.4 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.49 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.46 -41.75 53.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.19 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -73.17 -31.07 64.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.066 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.799 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.29 -27.71 66.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.63 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.791 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.4 t -59.41 -53.15 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.611 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -54.27 -23.68 15.88 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.065 177.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 12.3 t -86.71 -30.96 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.65 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.793 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.51 -41.18 61.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.208 179.059 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.541 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -70.17 -28.71 65.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.401 0.62 . . . . 0.0 110.078 179.156 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.522 ' O ' ' HA ' ' A' ' 128' ' ' LYS . . . -76.78 -34.14 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.649 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.471 ' HA ' ' HG2' ' A' ' 128' ' ' LYS . 0.6 OUTLIER -88.43 -48.3 7.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.411 -178.459 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.653 ' HG3' HD12 ' A' ' 122' ' ' LEU . 7.8 mm-40 -56.92 -60.8 3.05 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.77 68.86 2.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.507 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -63.25 102.8 0.43 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.255 0.55 . . . . 0.0 111.977 -176.28 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.47 7.79 27.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.231 -0.895 . . . . 0.0 108.887 175.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -86.54 -5.34 59.17 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.428 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.0 97.5 0.37 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.935 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -98.7 -68.62 0.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.152 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -85.07 51.55 2.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.936 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -86.84 55.87 3.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.158 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.6 p -98.79 -18.7 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.933 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 45.8 p-10 -85.45 8.39 19.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.941 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.1 m -82.53 86.91 6.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.929 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.52 -42.13 83.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.018 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.7 p -98.88 132.23 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.45 -78.32 1.41 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.474 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.5 t -85.74 111.84 40.53 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.198 . . . . 0.0 111.091 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.63 -29.61 85.91 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.551 2.167 . . . . 0.0 112.373 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.9 p -85.6 45.24 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.932 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.43 HG13 ' OXT' ' A' ' 144' ' ' VAL . 3.5 p . . . . . 0 C--O 1.25 1.088 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.63 -59.51 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.638 2.225 . . . . 0.0 112.235 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -97.09 13.67 28.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.5 112.22 3.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.497 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.4 t -95.15 -52.8 4.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.877 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.84 128.65 13.36 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.997 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 56.21 42.71 27.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.144 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.52 27.76 0.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.044 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -101.32 95.7 6.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.178 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 65.2 p 46.62 72.0 1.4 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.363 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -62.98 113.82 2.17 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.602 2.201 . . . . 0.0 112.145 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -20.74 35.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.062 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.0 t -89.13 110.63 21.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.16 168.6 17.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.946 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -91.53 160.75 15.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 1.7 t -103.76 110.81 64.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -67.58 -12.69 36.51 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.437 2.091 . . . . 0.0 112.269 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -73.62 108.53 6.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.857 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -76.41 124.22 27.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.956 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.23 103.39 14.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.17 123.03 18.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.53 -48.54 69.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.014 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 156.07 33.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.037 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.05 17.2 57.48 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.475 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.2 m -105.57 145.43 13.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.96 -156.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.797 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -69.54 114.81 26.99 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.729 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -57.0 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.547 2.165 . . . . 0.0 112.383 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -89.56 113.74 25.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.967 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -94.74 139.63 30.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -7.7 59.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.041 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 tp -86.22 69.72 10.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.829 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.34 132.18 49.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.01 -4.32 52.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.169 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -87.79 152.33 51.23 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.84 154.33 13.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.533 2.155 . . . . 0.0 112.42 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.4 137.5 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.846 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.2 p -102.5 149.38 7.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.03 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.57 174.64 6.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.998 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.9 mmt -84.89 -169.82 2.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.831 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -116.78 56.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.832 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 55.94 82.75 0.24 Allowed Pre-proline 0 C--N 1.332 -0.174 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.965 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.17 179.77 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.519 2.146 . . . . 0.0 112.356 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.63 101.85 0.66 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.204 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 4.8 m -92.61 142.78 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.046 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -85.72 98.61 10.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.2 t -94.83 144.62 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -71.26 -53.28 14.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.093 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.25 176.07 40.04 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.557 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 93.54 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 110.901 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -82.35 132.07 53.93 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.981 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.39 -175.64 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.598 2.199 . . . . 0.0 112.354 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -82.68 149.35 27.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.874 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -167.52 -175.42 2.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.305 179.401 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.14 -34.14 21.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.278 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 20.0 m -64.01 -44.79 91.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.627 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.823 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.25 -42.04 97.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.207 178.858 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -61.88 -44.5 96.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.759 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.71 -12.41 58.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.292 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.2 m -76.92 -16.77 59.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.792 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -134.51 60.58 43.75 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.059 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.767 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.2 Cg_exo -53.1 -51.8 10.23 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.549 2.166 . . . . 0.0 113.102 -179.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 65.9 Cg_endo -95.85 21.53 0.45 Allowed 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.582 2.188 . . . . 0.0 112.536 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.792 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 20.4 mm100 -127.1 -94.03 0.46 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.654 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.594 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -105.44 27.72 8.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.665 -177.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.767 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -59.04 -43.03 91.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.861 0.362 . . . . 0.0 110.676 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HA ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -117.29 41.33 2.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.743 179.339 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -136.46 -54.66 0.74 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.281 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.594 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.3 ptt? -80.54 -1.84 43.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.784 -178.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.81 -43.12 99.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.591 0.234 . . . . 0.0 111.559 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.986 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.48 28.24 3.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.349 -0.929 . . . . 0.0 112.684 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -140.91 -2.97 1.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 0.0 111.194 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.35 -23.1 3.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.059 0.457 . . . . 0.0 110.721 -179.819 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.04 -22.47 59.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.812 -178.894 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.679 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -44.95 -56.35 9.08 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.968 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.679 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.1 Cg_exo -61.12 -15.14 37.65 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.031 1.821 . . . . 0.0 112.371 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.725 HD12 ' HB2' ' A' ' 53' ' ' LEU . 82.9 mt -98.64 -25.51 14.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.909 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.7 mm -65.23 -38.64 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-O 121.009 0.433 . . . . 0.0 110.667 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.709 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.0 mt-30 -53.64 -14.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.827 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -88.2 -30.46 19.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.189 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.493 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -84.0 -46.63 11.83 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -173.554 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.771 ' N ' ' HA ' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -80.64 -35.57 0.86 Allowed Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 -171.309 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.771 ' HA ' ' N ' ' A' ' 82' ' ' HIS . 42.1 Cg_endo -96.41 -76.24 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.028 0 CA-C-N 120.65 1.268 . . . . 0.0 112.675 2.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.709 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.9 m -68.08 76.46 0.23 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.696 -178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 84' ' ' THR . 0.4 OUTLIER -145.68 10.33 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.43 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.601 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.79 42.43 0.3 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.448 -177.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -12.59 64.28 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.045 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.807 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.8 ttpt 177.04 36.9 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.042 0.449 . . . . 0.0 110.091 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.903 HG21 HG13 ' A' ' 115' ' ' VAL . 67.4 mt -79.72 -90.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.169 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.986 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.3 -39.62 57.27 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.26 -32.17 57.1 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.02 -1.085 . . . . 0.0 110.838 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.807 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.69 -25.57 32.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.367 178.637 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.617 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.3 mm? -59.6 -7.92 1.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.732 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 70' ' ' LEU . 1.8 mm? -106.19 27.33 8.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.5 pt-20 -166.43 1.53 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.463 -178.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.968 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.83 -151.48 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.384 0.611 . . . . 0.0 111.73 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.541 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.2 t0 -59.08 -3.83 0.42 Allowed 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.085 178.06 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-80 79.55 -29.03 0.14 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.544 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -32.6 61.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.168 0.509 . . . . 0.0 109.827 178.22 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.968 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.8 mt-10 -74.08 -23.49 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.999 177.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.477 ' CB ' HD11 ' A' ' 96' ' ' ILE . 1.5 tp -74.86 -25.64 59.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.863 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -88.27 -47.05 8.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.239 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.517 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.4 OUTLIER -63.12 -41.26 99.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.055 -178.912 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.862 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.6 OUTLIER -56.1 -34.0 65.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.348 -179.736 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.557 ' HA ' HD23 ' A' ' 58' ' ' LEU . 15.0 mt -87.15 -8.63 56.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.039 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 2.6 pt-20 -111.85 -7.98 14.15 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.68 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.42 131.7 14.08 Favored Pre-proline 0 C--N 1.331 -0.196 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.782 -179.134 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.575 ' O ' HG21 ' A' ' 54' ' ' THR . 16.7 Cg_exo -67.58 1.2 3.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.808 2.339 . . . . 0.0 112.103 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -127.19 -11.69 5.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.5 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.68 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -75.24 -46.16 35.6 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.292 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.874 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.48 -29.83 3.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.653 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -95.22 -64.06 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.076 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 27.8 t -46.24 -31.56 2.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.967 0.413 . . . . 0.0 109.981 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 15.8 mmtm -80.75 -41.05 24.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.88 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.903 HG13 HG21 ' A' ' 89' ' ' ILE . 1.5 t -64.38 -63.0 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.305 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.511 ' N ' HG12 ' A' ' 115' ' ' VAL . 9.6 t70 -48.84 -40.07 27.97 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 111.081 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.0 -35.61 66.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.796 0.332 . . . . 0.0 110.454 179.49 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.28 68.29 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.834 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.826 HG13 HD23 ' A' ' 122' ' ' LEU . 12.9 t -63.79 -47.76 89.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.141 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.58 37.09 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.455 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.8 t -87.13 -34.54 7.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.062 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.826 HD23 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -65.58 -33.56 76.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.335 178.209 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.434 ' O ' ' HB3' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -79.82 -24.76 41.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.703 177.685 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.603 ' O ' ' HB2' ' A' ' 130' ' ' ALA . . . -88.62 5.94 40.57 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.794 178.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -127.45 -27.62 2.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.994 0.426 . . . . 0.0 110.137 178.059 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.471 ' HB2' ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -87.91 -38.69 15.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.309 178.459 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 123' ' ' GLN . . . -95.36 -52.36 4.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.96 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.554 ' HG2' ' CA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.19 167.94 10.9 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.624 0.726 . . . . 0.0 111.094 179.69 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.1 86.08 6.81 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.571 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.603 ' HB2' ' O ' ' A' ' 124' ' ' ALA . . . -57.44 -62.37 1.83 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.138 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -86.15 149.81 24.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -98.61 51.85 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.908 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -68.39 -50.51 52.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -90.77 75.91 6.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.96 146.42 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.049 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -62.78 144.04 56.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.789 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.7 m -91.1 62.41 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.77 160.82 31.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.167 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.5 t -99.47 -21.66 15.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.874 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -84.44 173.84 50.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.466 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.43 125.03 89.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.698 0.285 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.6 142.18 25.8 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.513 2.142 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -16.72 38.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.053 179.959 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.167 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.85 -77.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.53 2.153 . . . . 0.0 112.348 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.7 -1.59 37.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.943 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.44 157.71 22.59 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.392 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.26 161.32 15.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 110.964 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.28 82.08 3.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.085 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -161.57 -54.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.61 -38.56 54.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.945 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -163.14 169.83 18.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.99 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.1 m 56.32 90.87 0.08 OUTLIER Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.093 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.552 ' HB2' HG23 ' A' ' 13' ' ' VAL . 28.7 Cg_endo -62.36 154.36 64.28 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.575 2.183 . . . . 0.0 112.205 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.99 34.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.552 HG23 ' HB2' ' A' ' 11' ' ' PRO . 4.8 t -100.29 147.28 7.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.018 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.6 mtt-85 -96.48 114.06 25.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.988 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.48 140.95 29.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 5.5 m -90.89 139.99 26.12 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 31.5 Cg_exo -59.66 -57.98 0.71 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.599 2.199 . . . . 0.0 112.173 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -89.03 151.83 22.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -75.06 -17.22 60.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.94 121.0 21.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -69.01 126.48 29.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.987 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.67 -162.65 0.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.002 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.63 99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.002 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.59 7.22 77.57 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.528 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 t -91.57 -41.83 13.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.5 mtt180 -71.08 102.54 2.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.481 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 73.2 m-20 -76.03 -51.83 2.72 Favored Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.383 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.481 ' HD3' ' HB2' ' A' ' 27' ' ' ASN . 72.0 Cg_endo -76.92 101.58 1.52 Allowed 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.119 1.879 . . . . 0.0 112.349 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -74.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -99.39 -18.28 17.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.757 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 55.25 39.61 31.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.013 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.84 91.87 8.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -91.47 -177.5 4.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.5 -2.19 30.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -81.05 152.06 70.92 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.09 50.19 3.45 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.725 2.284 . . . . 0.0 112.526 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -86.57 50.28 1.97 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.985 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -79.23 123.29 35.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.6 t -99.15 -12.44 20.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.939 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 9.6 ttt -100.98 92.12 4.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.083 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -148.47 137.55 21.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.706 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.685 ' N ' ' HA ' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -59.86 -50.64 85.64 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.533 -179.732 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.685 ' HA ' ' N ' ' A' ' 42' ' ' GLN . 67.7 Cg_endo -90.67 179.47 13.87 Favored 'Cis proline' 0 C--N 1.356 0.93 0 C-N-CA 124.599 -1.001 . . . . 0.0 112.503 0.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.96 132.74 53.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.093 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 m -80.83 133.76 28.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -98.48 -6.55 30.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.965 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 30.9 m -86.2 166.89 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.063 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -97.58 68.82 2.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.995 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -83.2 -71.36 1.32 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.472 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.96 157.57 18.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.737 0.303 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.66 ' N ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -77.98 -52.01 1.63 Allowed Pre-proline 0 CA--C 1.535 0.385 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.294 179.684 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.66 ' HA ' ' N ' ' A' ' 51' ' ' GLU . 95.4 Cg_endo -92.37 -41.34 0.28 Allowed 'Cis proline' 0 C--N 1.355 0.89 0 C-N-CA 124.657 -0.976 . . . . 0.0 112.884 0.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.95 HD22 ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER -74.53 141.28 44.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 111.186 -179.671 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.884 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.95 -168.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.331 179.308 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -54.79 -38.91 67.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.507 -179.518 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.463 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 1.2 m -60.42 -45.92 91.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 0.0 110.419 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.849 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.49 -43.14 88.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.065 178.688 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.15 -48.16 81.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.476 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.01 -2.6 15.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.355 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.469 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 27.7 t -88.99 -6.98 56.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.315 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.65 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.6 50.82 5.77 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.65 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 80.7 Cg_endo -103.06 121.71 0.07 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 123.016 2.477 . . . . 0.0 112.892 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.48 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 90.4 Cg_endo -100.26 124.96 1.48 Allowed 'Cis proline' 0 N--CA 1.455 -0.784 0 C-N-CA 124.51 -1.038 . . . . 0.0 112.41 0.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -168.26 -87.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.729 0.3 . . . . 0.0 111.134 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.563 ' HA ' ' HB3' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -96.15 6.89 47.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.857 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.0 -37.87 61.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.665 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -120.58 30.34 6.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.804 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.563 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 8.8 tt0 -131.69 -53.6 1.0 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.437 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.567 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -77.26 2.4 15.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.674 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.747 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -68.4 -39.49 81.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.611 -179.759 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.069 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.4 27.76 2.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.591 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -139.59 -10.16 1.22 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.618 0.247 . . . . 0.0 111.27 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.579 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.9 tmt_? -127.35 -14.82 5.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.307 . . . . 0.0 110.774 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.95 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.77 -14.63 59.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.484 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.643 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 5.6 t80 -49.39 -55.03 24.35 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.531 -178.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.4 Cg_exo -61.69 -9.35 13.51 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.083 1.855 . . . . 0.0 112.455 -179.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.69 -35.41 10.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.699 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.7 mm -60.09 -40.72 84.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.855 0.359 . . . . 0.0 110.601 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.779 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.2 mt-30 -49.19 -19.16 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.879 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.63 -41.63 17.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.908 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.449 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.31 -38.72 75.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.331 0.586 . . . . 0.0 110.412 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.717 ' CE1' HG21 ' A' ' 119' ' ' VAL . 5.3 m170 -121.71 148.69 51.37 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.442 -177.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.809 ' HD2' HD12 ' A' ' 85' ' ' LEU . 37.8 Cg_exo -60.33 74.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.441 2.094 . . . . 0.0 111.699 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.779 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.7 OUTLIER 48.83 28.33 1.88 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.643 -178.048 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.809 HD12 ' HD2' ' A' ' 83' ' ' PRO . 3.1 mt -80.69 2.41 26.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.146 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -68.05 -131.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.585 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.58 -18.55 6.97 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.045 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.864 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.3 ttpt -156.34 -20.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 70.1 mt -49.81 -79.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.069 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.78 -40.14 69.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.457 0.17 . . . . 0.0 110.824 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.33 -28.39 61.79 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.097 -1.049 . . . . 0.0 110.57 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.864 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.0 ttm -76.12 -36.69 58.72 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.581 0.705 . . . . 0.0 109.79 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.691 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -56.27 -9.47 0.67 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.619 -178.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.747 HD21 HD13 ' A' ' 70' ' ' LEU . 2.4 mm? -106.32 28.34 7.84 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 176.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.7 pt-20 -170.26 0.35 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.662 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.956 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.88 -148.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.464 0.65 . . . . 0.0 111.493 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -53.92 -10.14 0.3 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.99 176.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.698 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.5 m-80 79.87 -22.95 0.25 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.099 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -32.35 59.38 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.403 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.956 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -70.48 -29.89 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.864 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.695 HD23 HD22 ' A' ' 94' ' ' LEU . 2.2 tm? -69.36 -27.31 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.197 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.4 mp -87.96 -46.58 9.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.348 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.485 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.12 -39.83 90.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.567 -177.821 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.784 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.3 ptm -57.19 -35.87 70.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.715 0.293 . . . . 0.0 111.122 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.55 ' HA ' HD23 ' A' ' 58' ' ' LEU . 12.5 mt -85.7 -10.09 56.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.9 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.485 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -109.55 -8.51 14.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.175 -177.515 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.708 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -140.31 131.49 14.12 Favored Pre-proline 0 C--N 1.33 -0.276 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.865 -178.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 14.9 Cg_exo -69.14 2.4 3.21 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.978 2.452 . . . . 0.0 112.029 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -127.3 -11.99 5.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.671 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.708 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -77.16 -45.57 26.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.884 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.64 -41.21 14.37 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.779 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.6 -63.27 1.45 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.296 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -48.71 -55.11 12.31 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.348 . . . . 0.0 111.076 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 17.9 mmtt -57.6 -31.28 66.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.36 -58.63 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.204 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 115' ' ' VAL . 23.3 t70 -49.62 -38.92 33.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.285 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -43.99 68.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.187 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.724 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -58.4 -29.05 65.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.936 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.717 HG21 ' CE1' ' A' ' 82' ' ' HIS . 21.6 t -56.91 -51.5 67.4 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.789 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.02 -26.91 28.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.92 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.416 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 9.2 t -86.18 -31.03 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.875 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.76 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.92 -40.71 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.908 179.259 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 16.9 mm100 -61.97 -37.91 86.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.653 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.539 ' HB1' ' HE2' ' A' ' 128' ' ' LYS . . . -67.49 -79.87 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.235 176.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.462 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.6 OUTLIER -32.62 -36.13 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.705 0.628 . . . . 0.0 112.328 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 124' ' ' ALA . 12.4 mm100 -66.94 -78.33 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.303 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.46 26.55 4.31 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.776 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 1.2 ptpt -96.54 -161.62 0.89 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 111.122 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -87.93 26.59 1.32 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.674 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.776 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.28 -71.21 0.12 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.328 -177.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -81.14 -173.67 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -92.37 -69.95 0.72 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.993 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.83 -164.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.947 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.99 176.31 1.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.168 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.6 m -97.31 80.98 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.121 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -92.55 10.04 32.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.962 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.4 t -96.34 82.43 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -83.64 -72.01 0.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.14 -17.16 11.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -102.12 111.82 4.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.351 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 1.6 m -101.94 101.44 18.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.728 0.299 . . . . 0.0 111.187 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.81 -172.1 1.14 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.563 2.175 . . . . 0.0 112.316 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 p -83.87 -179.72 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.818 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.083 -179.909 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.436 -0.266 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.33 40.35 0.96 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.714 2.276 . . . . 0.0 112.435 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.05 141.99 41.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.58 164.92 28.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.505 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.5 p -101.26 -20.27 15.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.799 0.333 . . . . 0.0 110.984 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -128.33 1.93 5.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -92.33 -165.94 1.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.037 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.78 134.55 57.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -123.1 -18.56 6.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 48.6 p -92.96 141.38 24.08 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.009 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.43 108.95 2.63 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.512 2.141 . . . . 0.0 112.411 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.42 -30.71 21.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -104.18 143.15 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.071 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.8 mtt85 -71.67 119.13 15.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.977 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 p -111.27 117.35 32.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.602 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 t -88.29 -51.34 0.4 Allowed Pre-proline 0 CA--C 1.532 0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.496 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.602 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 31.5 Cg_exo -59.34 121.91 10.68 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.198 1.932 . . . . 0.0 112.239 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -72.91 -178.71 2.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -75.02 81.93 2.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.923 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.52 161.35 13.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.54 -175.7 5.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -89.79 -62.22 1.52 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.065 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.49 165.53 11.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.174 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.98 42.87 3.19 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -98.93 132.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.328 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -93.27 112.01 23.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -83.88 110.25 24.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.65 81.1 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.47 2.113 . . . . 0.0 112.288 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -95.58 69.88 3.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.07 162.99 28.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -107.3 66.35 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.87 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.23 -37.11 11.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.965 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -77.38 -27.83 52.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.94 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.99 92.25 8.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -98.17 137.05 20.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.4 -153.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.52 2.146 . . . . 0.0 112.228 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.37 60.25 3.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -103.48 38.31 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.962 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 m -82.46 -21.44 35.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.961 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.1 tpp -88.11 3.18 50.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.0 tp60 -165.45 100.98 0.71 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.009 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -147.55 137.95 12.66 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.08 122.57 11.66 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.645 2.23 . . . . 0.0 112.313 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.75 118.04 28.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.0 t -83.52 103.99 11.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -108.03 58.14 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.822 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.799 HG22 ' H ' ' A' ' 49' ' ' GLY . 11.0 p -89.11 146.33 6.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.021 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -90.16 -0.14 57.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.088 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.799 ' H ' HG22 ' A' ' 47' ' ' VAL . . . -89.24 17.83 49.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.493 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -97.18 172.93 7.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.86 0.362 . . . . 0.0 110.911 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.485 ' HG2' ' H ' ' A' ' 51' ' ' GLU . 4.1 pt-20 -75.56 120.01 79.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.08 173.4 0.94 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.58 2.187 . . . . 0.0 112.309 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.824 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -80.77 143.78 32.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -164.64 -167.92 1.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.329 179.388 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.516 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -56.84 -37.44 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.093 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.1 m -61.12 -43.61 98.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.389 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.824 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -62.26 -41.49 98.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.149 178.55 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -59.25 -46.13 89.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.546 179.151 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.99 -12.17 61.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.3 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 28.5 t -76.37 -8.63 57.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.832 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.549 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -133.46 128.68 20.28 Favored Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.329 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.555 ' O ' ' N ' ' A' ' 64' ' ' GLN . 45.5 Cg_exo -55.0 -164.49 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 122.728 2.285 . . . . 0.0 110.698 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.434 ' HD2' ' CB ' ' A' ' 62' ' ' PRO . 82.7 Cg_exo -42.75 -14.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.935 1.757 . . . . 0.0 112.53 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.555 ' N ' ' O ' ' A' ' 62' ' ' PRO . 11.4 mt-30 -39.4 -88.42 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.414 177.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.762 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -105.38 8.51 33.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.935 -179.459 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -57.98 -24.48 58.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.05 0.452 . . . . 0.0 110.772 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.625 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -130.32 25.08 5.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 179.62 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.492 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 40.7 tt0 -130.25 -58.02 1.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.92 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.762 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -74.0 18.02 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.13 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.626 ' N ' HD23 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -89.41 -39.46 13.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.119 0.485 . . . . 0.0 110.491 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.05 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.74 16.41 5.34 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.198 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -133.84 -11.09 2.67 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.477 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.585 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.77 -14.05 5.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.843 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.76 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.82 -12.06 59.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.131 179.392 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.735 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.1 t80 -46.81 -54.29 20.66 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.024 -178.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.735 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.1 Cg_exo -62.67 -15.62 47.54 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.205 1.937 . . . . 0.0 112.286 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.637 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.2 mm? -93.25 -28.13 16.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.486 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.771 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.0 mm -70.61 -40.18 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.781 0.324 . . . . 0.0 111.187 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.807 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 17.8 mt-30 -53.29 -16.43 1.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.346 0.593 . . . . 0.0 110.22 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.83 -37.23 22.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.062 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.771 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.17 -35.96 61.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.046 0.45 . . . . 0.0 110.704 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.9 m-70 -125.24 161.98 46.7 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.861 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.81 ' HG2' HD13 ' A' ' 85' ' ' LEU . 45.7 Cg_endo -67.59 72.16 0.66 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.402 2.068 . . . . 0.0 112.041 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.807 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 66.1 p 46.83 41.89 11.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.356 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.81 HD13 ' HG2' ' A' ' 83' ' ' PRO . 2.3 mp -99.15 11.06 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.69 22.33 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.986 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.04 -17.15 35.74 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.657 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.3 ttpt -168.95 29.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.816 0.341 . . . . 0.0 111.06 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.884 HG21 HG13 ' A' ' 115' ' ' VAL . 67.5 mt -80.7 -90.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.07 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.05 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -52.04 -41.73 62.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.07 -32.31 49.64 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.113 -1.042 . . . . 0.0 111.146 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.685 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.69 -22.39 27.87 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 120.908 0.385 . . . . 0.0 110.45 179.437 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.586 ' HA ' HG23 ' A' ' 96' ' ' ILE . 3.9 mm? -60.22 -10.01 4.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.195 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.638 HD23 ' HA3' ' A' ' 71' ' ' GLY . 2.2 mm? -102.91 26.43 8.13 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.3 pt-20 -165.5 -0.62 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.916 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.94 -151.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.397 0.618 . . . . 0.0 111.633 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.7 t0 -53.83 -10.05 0.28 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.151 176.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.751 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.8 OUTLIER 79.16 -23.03 0.26 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.191 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -76.53 -25.98 54.72 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -77.96 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.779 177.265 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.776 ' HG ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.5 -21.41 66.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.865 178.094 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.776 HD23 ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -88.68 -52.4 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.23 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.6 OUTLIER -63.36 -38.75 92.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.223 -178.56 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.78 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -56.85 -35.1 68.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.743 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.567 HD21 HD13 ' A' ' 70' ' ' LEU . 21.7 mt -86.89 -10.15 54.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.942 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.18 -4.64 15.65 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -177.029 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.815 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -141.93 130.0 11.81 Favored Pre-proline 0 C--N 1.332 -0.192 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.597 -179.918 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.536 ' O ' HG21 ' A' ' 54' ' ' THR . 21.9 Cg_exo -66.47 6.25 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.402 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.4 OUTLIER -131.54 -24.25 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.538 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.815 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.13 -42.62 99.54 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.76 -28.55 2.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.357 175.706 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.9 mtp85 -95.89 -66.63 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.073 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 22.7 t -44.93 -30.36 0.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.306 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -80.79 -42.27 22.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.953 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.884 HG13 HG21 ' A' ' 89' ' ' ILE . 1.9 t -64.25 -60.18 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.279 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.436 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.5 OUTLIER -51.31 -39.61 57.25 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.078 179.442 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.512 ' HB2' ' O ' ' A' ' 113' ' ' SER . 2.1 mt-10 -73.21 -33.9 65.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.916 0.388 . . . . 0.0 110.151 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.685 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.08 -27.46 67.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.668 HG11 ' ND1' ' A' ' 82' ' ' HIS . 22.0 t -60.57 -47.46 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.05 -25.9 59.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.557 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 5.1 t -86.56 -31.26 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.799 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.6 -40.08 66.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.927 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -64.02 -38.59 91.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.94 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.737 ' HB1' ' HE2' ' A' ' 128' ' ' LYS . . . -70.96 -77.72 0.08 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.396 177.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.3 OUTLIER -33.19 -34.58 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.725 0.641 . . . . 0.0 112.279 -178.237 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 124' ' ' ALA . 2.3 mt-30 -65.03 -80.76 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.271 179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.48 25.82 4.81 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.737 ' HE2' ' HB1' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.18 -163.09 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.221 0.534 . . . . 0.0 111.054 179.128 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.92 29.41 0.93 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.706 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.696 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.73 -71.74 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.436 -177.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.06 169.84 16.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.242 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.29 45.26 1.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.963 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -60.66 -58.66 7.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.907 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -91.08 141.72 28.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.155 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.7 t -87.67 43.96 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.949 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -74.74 103.89 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.54 -169.77 2.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.881 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.47 132.86 51.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.094 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.53 -162.71 0.96 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.86 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -101.31 -14.65 29.92 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.575 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.602 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 4.0 t -84.78 -50.89 0.56 Allowed Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.602 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 32.2 Cg_exo -59.47 -12.57 17.52 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.241 1.961 . . . . 0.0 112.468 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -74.92 0.21 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.874 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.095 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.74 158.55 56.6 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.576 2.184 . . . . 0.0 112.242 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -97.34 102.28 14.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.918 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.56 -80.55 1.54 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.609 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.8 m -85.31 -169.77 2.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.742 0.306 . . . . 0.0 110.922 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.6 -92.8 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.099 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.93 76.28 0.26 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.98 -33.07 0.34 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.073 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.83 13.28 14.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.057 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.573 HG22 ' HD2' ' A' ' 11' ' ' PRO . 0.0 OUTLIER -119.94 145.52 39.9 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.962 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.573 ' HD2' HG22 ' A' ' 10' ' ' THR . 65.6 Cg_endo -73.26 175.76 10.12 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.537 2.158 . . . . 0.0 112.28 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.49 -17.94 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.946 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.95 82.62 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.028 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -78.5 -13.69 59.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.8 p -110.48 163.56 13.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.405 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 3.4 m -102.74 125.63 35.14 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.091 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 47.8 Cg_exo -56.65 -56.24 2.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.58 2.187 . . . . 0.0 112.343 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.29 148.53 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.038 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.86 172.08 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.985 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -77.19 167.0 22.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.873 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -84.8 104.39 14.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.931 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.89 -173.95 1.35 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.015 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.59 117.61 13.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.101 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.94 33.1 4.57 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.4 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 25' ' ' VAL . 7.3 p -105.81 36.25 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-O 121.312 0.577 . . . . 0.0 110.831 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.51 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -73.45 -169.68 0.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.076 179.898 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.63 ' H ' ' HD2' ' A' ' 28' ' ' PRO . 1.5 m-20 -94.22 -51.17 0.25 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.661 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.63 ' HD2' ' H ' ' A' ' 27' ' ' ASN . 32.8 Cg_endo -63.65 115.4 3.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.129 1.886 . . . . 0.0 112.347 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -78.87 155.4 29.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.789 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.49 108.26 20.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.04 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 14.19 17.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.837 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.01 -62.87 1.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -82.3 -75.75 0.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.86 120.11 15.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.071 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.497 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -86.34 -51.3 0.47 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.519 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 57.7 Cg_endo -71.01 129.27 16.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.149 1.899 . . . . 0.0 112.335 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -101.6 24.3 9.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.841 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.1 p -97.28 -9.7 8.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.099 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.54 -64.29 1.22 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.113 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.54 64.5 8.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.101 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -160.34 38.18 0.17 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.905 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -157.49 105.02 1.83 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.003 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.91 149.49 59.67 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.481 2.121 . . . . 0.0 112.274 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.48 109.39 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.111 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.77 175.92 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.02 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -98.53 155.76 17.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.886 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 27.1 m -85.93 155.38 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.031 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.14 -34.3 63.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.06 105.82 2.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.356 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.06 49.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.879 0.371 . . . . 0.0 111.173 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.629 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 20.7 mt-10 -74.47 -50.74 4.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.301 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.629 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 31.8 Cg_exo -59.54 121.35 9.73 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.297 1.998 . . . . 0.0 112.319 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.513 HD12 ' CD1' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -69.46 134.64 49.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.033 179.841 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.916 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -169.8 -177.81 2.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.175 178.312 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.953 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.32 -35.79 51.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.806 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 5.7 m -66.58 -47.91 71.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.364 . . . . 0.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.806 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.17 -41.98 85.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.258 0.551 . . . . 0.0 110.369 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.953 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.1 mt -63.17 -45.94 89.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.812 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.58 -10.34 44.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.488 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -83.15 -8.02 59.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.736 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.747 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.37 56.63 21.93 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.182 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.722 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 53.6 Cg_exo -52.73 -51.17 11.72 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.491 2.127 . . . . 0.0 113.337 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.588 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 67.8 Cg_endo -94.58 12.56 1.55 Allowed 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.434 2.089 . . . . 0.0 112.632 -179.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.747 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 5.5 tt0 -122.13 -95.07 0.49 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.628 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.691 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 0.0 OUTLIER -106.99 37.09 2.45 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.179 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.722 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -59.62 -50.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.96 0.41 . . . . 0.0 110.497 179.514 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -116.51 36.03 4.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.577 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -126.76 -50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.421 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.656 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.2 OUTLIER -80.62 -3.38 50.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.642 -178.668 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.771 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.09 -38.57 86.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.39 -179.767 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.94 28.91 2.78 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.581 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -142.95 0.18 1.19 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.428 ' CB ' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -130.37 -22.62 2.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.692 179.157 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -75.98 -24.88 55.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.826 178.857 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.467 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -41.14 -55.96 4.58 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.044 -177.931 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.0 Cg_endo -71.48 -15.37 30.94 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.028 1.819 . . . . 0.0 112.232 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 81.3 mt -92.16 -20.64 21.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.524 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.71 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.6 mm -73.08 -36.17 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HG2' HG22 ' A' ' 84' ' ' THR . 3.7 mt-30 -52.8 -13.06 0.37 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.097 177.082 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -84.09 -44.42 14.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.9 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.71 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.45 -35.78 73.53 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.526 0.679 . . . . 0.0 110.164 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.683 ' ND1' HD13 ' A' ' 89' ' ' ILE . 5.5 m170 -119.53 139.91 28.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.944 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.429 ' O ' HG23 ' A' ' 84' ' ' THR . 54.7 Cg_exo -30.98 -48.91 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.82 2.347 . . . . 0.0 112.215 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.627 HG22 ' HG2' ' A' ' 79' ' ' GLN . 0.0 OUTLIER 176.59 14.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.89 177.509 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.86 3.87 0.97 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.424 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.729 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.32 47.37 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.247 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.78 -7.32 78.48 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.943 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 4.8 ttpt -174.4 28.35 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.783 0.325 . . . . 0.0 110.977 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 56.1 mt -80.1 -83.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.757 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.1 -40.88 59.43 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.476 0.179 . . . . 0.0 110.669 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.14 -31.76 56.46 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.943 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 4.6 ttm -73.8 -39.34 64.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.272 176.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -54.18 -10.76 0.39 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.843 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.771 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -105.15 28.68 7.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -171.52 -0.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.04 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.996 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.92 -150.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.488 0.661 . . . . 0.0 111.735 -179.325 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.6 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.7 t70 -55.49 -9.35 0.47 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.204 176.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.733 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.3 m120 79.45 -24.64 0.2 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.103 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -74.32 -29.35 61.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.996 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.57 -38.53 62.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.556 176.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.571 ' N ' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -64.23 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.986 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.36 -48.62 7.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.203 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.453 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.1 -41.43 94.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.318 -178.299 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.839 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -56.32 -34.31 66.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.443 -179.354 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.668 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.2 mt -86.66 -11.22 51.95 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.797 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.16 -7.99 15.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.737 0.644 . . . . 0.0 112.737 -176.68 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -141.95 135.73 14.63 Favored Pre-proline 0 C--N 1.332 -0.164 0 C-N-CA 120.598 -0.441 . . . . 0.0 112.008 -178.69 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.503 ' O ' HG21 ' A' ' 54' ' ' THR . 62.5 Cg_endo -72.18 0.52 7.19 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.697 2.265 . . . . 0.0 111.906 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -123.99 -10.89 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.323 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.81 -46.89 17.75 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.095 0.474 . . . . 0.0 109.737 178.059 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.916 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.5 -39.62 16.49 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.163 176.336 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.425 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.5 ttt-85 -80.18 -59.2 2.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.273 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.425 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 3.3 t -52.66 -56.82 12.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.981 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.595 ' HD3' ' HG3' ' A' ' 100' ' ' GLU . 0.8 OUTLIER -55.21 -32.24 62.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.8 t -69.58 -60.96 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.079 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.435 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.7 OUTLIER -50.24 -36.8 32.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 111.176 178.767 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -38.99 65.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.263 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.635 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -61.85 -30.02 70.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 177.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 115' ' ' VAL . 14.6 t -56.2 -53.74 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.933 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.44 -27.07 22.78 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.928 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.562 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 9.2 t -85.68 -31.71 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.954 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -70.82 -43.39 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.815 179.211 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.508 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 18.1 mm100 -68.88 -25.6 64.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.214 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.435 ' HA ' ' CD ' ' A' ' 128' ' ' LYS . . . -88.66 -12.67 41.77 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.354 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.787 ' HA ' ' HB3' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -114.07 -2.92 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.499 -179.057 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 122' ' ' LEU . 5.8 mm100 -68.65 -103.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.079 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.25 18.01 13.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.77 0.319 . . . . 0.0 111.252 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.435 ' CD ' ' HA ' ' A' ' 124' ' ' ALA . 0.2 OUTLIER -79.97 -156.22 0.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.113 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -87.2 -14.65 40.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.613 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.787 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . . . -69.38 -13.8 62.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.097 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.84 101.75 0.22 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.086 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -80.53 137.85 36.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.957 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -80.52 154.36 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -93.34 77.39 4.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.015 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.62 -28.88 3.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -84.83 166.39 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.013 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.61 16.22 16.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -84.69 -2.54 57.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.023 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.68 143.62 26.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -79.18 112.5 3.46 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.574 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 10.5 m -78.64 140.72 59.54 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.088 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.7 103.4 1.56 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.496 2.13 . . . . 0.0 112.329 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.1 m -83.51 -74.34 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.014 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.014 -179.992 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.45 161.49 31.12 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.616 2.211 . . . . 0.0 112.15 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.99 25.06 6.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.38 -10.73 67.73 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.418 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -76.63 -178.44 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.45 23.01 2.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -161.61 -95.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.52 20.66 5.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.283 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -165.39 -37.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.103 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.5 89.37 0.11 Allowed Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.06 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.3 155.48 55.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.528 2.152 . . . . 0.0 112.287 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.52 -67.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.986 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.96 134.59 29.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.034 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 -33.73 22.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.037 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.1 m -82.75 146.88 28.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.048 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.65 127.25 33.06 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.465 ' HB2' ' H ' ' A' ' 18' ' ' GLN . 88.1 Cg_endo -77.8 -134.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.563 2.176 . . . . 0.0 112.161 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.465 ' H ' ' HB2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -70.73 155.76 40.36 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 110.886 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -79.26 58.58 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.127 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.63 85.3 2.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.009 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -88.6 74.6 8.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.944 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -89.85 153.96 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.041 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.55 35.04 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.068 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.81 -4.83 89.57 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.492 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.7 t -108.38 -33.34 2.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.82 0.343 . . . . 0.0 110.958 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -77.13 140.0 40.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.91 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -71.8 147.96 92.02 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.68 100.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.517 2.145 . . . . 0.0 112.288 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -85.67 80.09 9.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -89.38 168.13 12.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -64.14 -30.13 71.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 mp -92.17 104.08 16.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.976 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -84.91 -55.98 3.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.811 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -94.59 177.17 6.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.064 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -104.89 102.36 34.95 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.02 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.36 113.99 3.79 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.397 2.065 . . . . 0.0 112.262 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.415 ' OE1' HG11 ' A' ' 47' ' ' VAL . 43.8 mt-30 -85.01 122.72 29.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.975 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.99 137.43 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.952 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -105.6 108.73 20.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.998 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.12 127.42 46.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -105.01 103.32 12.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.012 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.421 ' HA ' ' HA ' ' A' ' 43' ' ' PRO . 5.5 mt-30 58.33 95.23 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.203 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 42' ' ' GLN . 87.8 Cg_endo -81.72 138.42 39.39 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.528 -1.447 . . . . 0.0 112.541 -0.034 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -90.12 104.38 16.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.033 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.28 141.58 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.181 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -87.48 158.6 18.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.497 ' HB ' ' H ' ' A' ' 48' ' ' GLN . 1.7 m -110.83 -157.09 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.962 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.497 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 22.3 mt-30 -68.07 -176.89 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.927 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.84 37.66 3.07 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.509 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.68 37.53 1.69 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.722 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' N ' ' CD ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -77.6 -48.69 2.26 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.574 -179.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' CD ' ' N ' ' A' ' 51' ' ' GLU . 52.0 Cg_exo -55.87 178.0 0.12 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.317 2.012 . . . . 0.0 112.452 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.869 ' H ' HD23 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -79.76 141.21 36.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.164 -179.554 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.68 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.33 -169.06 1.01 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.682 178.916 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 1.017 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -53.52 -40.26 65.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.665 0.269 . . . . 0.0 111.431 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.5 m -59.27 -51.54 69.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.715 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.581 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.56 -39.11 79.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.296 179.069 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 55' ' ' ALA . 17.8 mt -62.9 -42.89 99.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.89 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.2 -16.72 62.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.148 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.9 m -74.19 -7.21 51.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.61 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.65 60.12 44.5 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.357 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.621 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 47.0 Cg_exo -56.63 -51.97 7.96 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.448 2.099 . . . . 0.0 113.246 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 74.9 Cg_endo -89.87 -18.01 1.57 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 122.262 1.975 . . . . 0.0 112.537 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.61 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.9 OUTLIER -80.91 -80.57 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.731 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.59 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.3 OUTLIER -106.85 -91.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.621 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER 71.69 -63.53 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.397 -178.489 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.483 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.08 25.22 12.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 178.856 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 2.2 mm100 -121.58 -50.76 2.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -81.17 5.97 15.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.92 -178.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.799 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.86 -57.27 8.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 179.816 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.007 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -113.05 33.62 5.49 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.732 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -144.41 -3.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.824 0.345 . . . . 0.0 111.297 -178.686 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.659 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -125.68 -26.26 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.527 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.841 HD22 HD22 ' A' ' 53' ' ' LEU . 1.6 mm? -63.5 -33.14 74.92 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.297 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.796 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.2 t80 -39.2 -60.23 1.27 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.796 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 32.5 Cg_exo -57.92 -19.45 39.8 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 121.851 1.701 . . . . 0.0 112.342 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.869 HD23 ' H ' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -98.83 -25.96 14.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.318 -178.109 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.679 HG12 ' O ' ' A' ' 74' ' ' LEU . 5.4 mm -65.85 -40.03 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.782 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -51.5 -19.36 1.4 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.521 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.26 -36.85 26.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.837 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.49 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.79 -34.56 64.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.6 m-70 -130.44 148.03 68.3 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.572 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 85' ' ' LEU . 51.2 Cg_exo -55.65 79.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.537 2.158 . . . . 0.0 112.364 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.782 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.0 p 42.89 37.68 1.17 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.529 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 10.8 mt -95.66 12.46 29.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.1 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.471 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.02 24.16 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.558 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.18 -19.14 44.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.681 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.644 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -169.11 32.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.89 0.376 . . . . 0.0 111.012 179.681 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.805 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -80.56 -92.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.888 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.007 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.82 -40.56 56.02 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.01 -31.33 55.78 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.209 -0.996 . . . . 0.0 110.973 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.709 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.79 -22.16 29.67 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 120.864 0.364 . . . . 0.0 110.098 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -62.48 -4.41 1.9 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.195 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -106.61 24.32 12.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.131 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.465 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 10.5 pt-20 -166.8 0.83 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.481 -178.746 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -152.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.554 0.693 . . . . 0.0 111.797 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.459 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.4 t0 -59.27 -3.28 0.38 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.157 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.62 -34.07 0.14 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.244 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -69.18 -24.79 64.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.102 178.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.904 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.3 mt-10 -84.04 -27.05 28.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.427 177.253 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.1 OUTLIER -74.89 -27.48 60.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.246 175.886 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.434 HD23 HD23 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -83.92 -48.79 9.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.873 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.534 ' ND1' ' HB3' ' A' ' 110' ' ' SER . 0.2 OUTLIER -61.93 -47.74 83.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.422 -178.57 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.716 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 5.7 ptm -52.15 -36.44 51.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.455 -178.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.81 HD23 HD13 ' A' ' 58' ' ' LEU . 54.4 mt -81.83 -14.71 55.94 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.857 -179.211 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.479 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.2 -10.61 16.38 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -176.934 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.534 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -143.2 136.27 13.86 Favored Pre-proline 0 N--CA 1.465 0.278 0 C-N-CA 120.283 -0.567 . . . . 0.0 112.241 -178.62 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.561 ' O ' HG21 ' A' ' 54' ' ' THR . 7.6 Cg_exo -73.69 3.88 4.52 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.017 2.478 . . . . 0.0 112.156 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -123.99 -22.07 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.561 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.534 ' HB3' ' ND1' ' A' ' 103' ' ' HIS . 2.4 p -64.05 -55.97 18.32 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.377 0.608 . . . . 0.0 109.857 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.5 tt -48.8 -31.09 6.48 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.572 -179.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.2 ttt85 -88.17 -60.56 1.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.308 -179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.4 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 49.6 m -56.5 -34.75 67.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.122 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -78.5 -31.22 47.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.78 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.805 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.77 -51.71 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.31 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -32.96 69.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.336 177.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -79.58 -31.07 41.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.574 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.709 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -68.32 -23.77 64.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.492 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 17.0 t -64.86 -57.24 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.609 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -53.27 -23.78 9.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.885 177.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 24.2 t -86.62 -32.54 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.433 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.68 -43.87 65.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.234 179.207 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.549 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -66.19 -31.5 72.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.829 178.327 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.434 ' HA ' ' CD ' ' A' ' 128' ' ' LYS . . . -81.76 -16.28 51.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.139 179.133 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -112.51 8.21 19.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.172 -179.566 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -77.3 -105.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.809 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.58 23.01 6.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.787 0.327 . . . . 0.0 111.325 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.434 ' CD ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -89.04 -146.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.138 -179.483 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.62 19.35 1.05 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.693 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -62.09 -54.47 40.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.087 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -82.43 118.27 23.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.018 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -89.47 -78.34 0.36 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.26 134.4 41.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.62 -69.84 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.046 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 15.2 m -103.05 139.46 23.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.021 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.39 59.58 4.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.44 145.92 29.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.891 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.82 -35.53 78.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.997 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 97.71 10.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.04 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -107.2 -144.46 11.58 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.641 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.417 ' HA ' ' HA ' ' A' ' 142' ' ' PRO . 6.2 p -72.43 134.38 82.34 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.444 0.164 . . . . 0.0 111.025 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' ' 141' ' ' VAL . 61.3 Cg_endo -90.28 -77.61 0.0 OUTLIER 'Cis proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.777 -1.343 . . . . 0.0 112.583 0.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.3 m -99.57 -67.59 0.84 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.824 0.345 . . . . 0.0 110.888 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 9.5 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.037 -179.841 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 121.96 8.82 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.578 2.185 . . . . 0.0 112.356 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.0 3.57 33.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.778 179.876 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.5 149.06 16.65 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.563 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.4 m -93.84 47.79 1.24 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.683 0.278 . . . . 0.0 110.947 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.71 115.38 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.19 69.28 0.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.056 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.72 142.75 36.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.125 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -104.79 18.31 22.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.121 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.0 p -120.14 86.31 37.35 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.29 142.08 48.96 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.594 2.196 . . . . 0.0 112.348 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.42 32.91 2.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 179.701 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 t -89.76 101.08 11.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.096 179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -77.26 -5.7 50.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.684 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.95 -162.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.907 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.89 118.93 42.0 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.13 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.34 -16.2 31.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.602 2.202 . . . . 0.0 112.288 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -92.93 122.51 35.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.895 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -78.2 174.96 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.21 131.94 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.97 179.716 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -86.12 96.99 10.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.3 95.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.072 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.72 113.09 9.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.058 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.21 -14.22 39.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.503 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.0 p -98.85 141.28 16.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.12 157.42 20.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.828 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.41 118.78 62.89 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.952 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.69 -64.52 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.56 2.173 . . . . 0.0 112.115 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -99.8 -167.99 1.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.75 -88.02 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.852 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 55.48 19.8 3.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 33' ' ' ASN . 0.1 OUTLIER -99.63 177.08 5.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.988 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.503 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -88.46 -171.68 3.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.805 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.41 120.06 23.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -51.11 1.19 Allowed Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.393 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.42 137.01 75.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.134 1.89 . . . . 0.0 112.215 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -92.31 139.82 30.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.811 179.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -90.7 117.47 34.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.275 -179.667 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -104.8 -44.87 4.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 179.521 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -146.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.703 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.412 ' HB3' ' H ' ' A' ' 42' ' ' GLN . 11.3 mm100 58.0 -146.88 0.52 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.743 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.412 ' H ' ' HB3' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -56.04 123.1 51.94 Favored Pre-proline 0 C--O 1.232 0.181 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.932 -179.911 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.53 121.86 10.69 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.62 2.214 . . . . 0.0 112.475 -179.438 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -84.16 122.66 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.917 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.524 HG21 ' HE ' ' A' ' 112' ' ' ARG . 3.8 m -82.72 2.66 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.354 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -87.95 130.98 34.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.82 179.936 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.777 HG12 ' H ' ' A' ' 49' ' ' GLY . 11.4 t -106.24 131.2 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.019 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -84.51 -5.93 59.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.929 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.777 ' H ' HG12 ' A' ' 47' ' ' VAL . . . -93.2 -93.4 1.51 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.469 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.54 142.41 35.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.813 0.34 . . . . 0.0 110.856 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 119.95 74.29 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.896 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.09 164.04 13.11 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.631 2.221 . . . . 0.0 112.264 -179.84 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.793 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -76.74 147.06 37.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.841 179.75 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -169.44 -161.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.37 179.229 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.6 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -58.26 -35.38 71.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.394 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 72.9 m -60.39 -49.43 77.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.223 179.156 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.793 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.22 -42.34 86.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.306 178.659 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.616 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.93 -45.11 91.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.815 179.459 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.27 -16.07 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.337 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.5 t -75.95 -13.52 60.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.744 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.758 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -134.89 61.1 45.31 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.993 179.497 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.809 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 52.9 Cg_exo -54.95 -53.1 6.52 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.451 2.101 . . . . 0.0 113.245 -178.801 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.5 Cg_endo -97.69 11.14 1.03 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 122.58 2.187 . . . . 0.0 112.567 -179.28 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.758 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 20.6 mm-40 -113.97 -93.6 0.48 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.593 -178.662 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.803 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.11 36.89 2.52 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.044 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.809 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.02 -35.89 81.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 0.0 110.505 179.086 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -118.87 39.69 3.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.785 179.55 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -135.82 -59.27 0.76 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.371 -179.572 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.803 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 5.5 ptt? -79.89 12.48 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.859 -178.634 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.807 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -76.62 -40.56 48.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.748 0.309 . . . . 0.0 111.077 179.052 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.047 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -133.7 23.98 3.72 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.224 -0.989 . . . . 0.0 112.693 -179.276 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.61 -7.37 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.708 0.29 . . . . 0.0 111.225 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.8 tmt_? -127.13 -15.25 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.906 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.673 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.11 -8.86 58.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.228 179.524 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.711 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.1 t80 -50.02 -55.82 21.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.445 -178.516 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 19.9 Cg_exo -64.89 -9.64 22.11 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.057 1.838 . . . . 0.0 111.852 179.513 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.784 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.9 mm? -93.22 -34.21 13.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.365 -179.52 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.778 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.5 mm -66.74 -38.87 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.872 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.729 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.4 mt-30 -50.93 -18.25 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.444 0.64 . . . . 0.0 110.198 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -83.82 -43.11 15.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.225 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.71 -38.73 73.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.427 0.632 . . . . 0.0 110.424 -179.898 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.659 ' ND1' HD13 ' A' ' 89' ' ' ILE . 3.9 m170 -121.95 151.24 57.75 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.414 -177.132 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.826 ' HG2' HD23 ' A' ' 85' ' ' LEU . 30.5 Cg_endo -62.58 75.82 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.272 1.982 . . . . 0.0 111.778 179.544 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.729 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 50.43 28.85 3.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.743 -178.786 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.826 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -80.22 0.62 31.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.375 -178.897 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.756 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.78 -144.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.47 -3.58 86.12 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.915 -179.441 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.73 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -167.82 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.778 -0.211 . . . . 0.0 111.111 -179.826 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.836 HG21 HG13 ' A' ' 115' ' ' VAL . 76.6 mt -49.68 -82.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.689 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.047 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -55.57 -38.12 68.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.597 0.237 . . . . 0.0 110.729 179.748 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.54 -29.05 57.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.686 177.34 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.591 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.3 ttp -76.88 -33.62 57.82 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.098 -0.551 . . . . 0.0 109.876 177.374 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.553 ' O ' HD23 ' A' ' 101' ' ' LEU . 4.6 mm? -59.86 -5.2 0.88 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.642 -178.215 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.807 HD11 HD13 ' A' ' 70' ' ' LEU . 3.2 mp -109.08 25.78 11.4 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 176.483 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -169.91 3.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.289 -178.391 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.942 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.06 -151.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.242 0.544 . . . . 0.0 111.66 -179.752 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 6.3 t0 -59.53 -2.48 0.34 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.206 178.308 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-80 78.0 -28.74 0.16 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.443 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 m -75.32 -27.05 59.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.054 0.454 . . . . 0.0 109.888 178.092 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.942 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -80.41 -22.19 41.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.938 177.916 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.1 tm? -75.2 -24.98 57.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.723 176.73 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.3 mp -90.25 -45.14 9.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.359 -179.21 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.09 -36.79 80.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.007 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.632 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.87 -36.03 73.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 179.785 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.616 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.7 mt -87.01 -10.47 53.05 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.186 0.517 . . . . 0.0 109.991 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -108.02 -3.46 18.72 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.157 -176.493 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -150.75 131.46 7.22 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.204 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.485 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.03 -2.02 8.04 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.931 2.42 . . . . 0.0 112.064 179.509 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.463 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -117.31 -28.52 6.12 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.343 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.821 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -62.63 -42.93 99.87 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.469 -178.887 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.9 tt -61.25 -30.6 70.55 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.281 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.528 ' HG2' ' N ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -89.48 -63.52 1.27 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 0.0 110.5 180.0 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.528 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 2.7 m -49.41 -36.85 23.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.386 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.473 ' HD2' ' OE2' ' A' ' 100' ' ' GLU . 33.3 mmtt -80.1 -35.71 36.47 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.044 178.794 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.836 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.59 -50.23 81.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.561 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.82 -37.16 68.29 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.094 178.304 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -39.67 69.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.85 178.487 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.66 -25.97 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 115' ' ' VAL . 17.0 t -59.68 -53.94 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.496 176.638 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.23 -26.37 28.3 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.918 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.76 -31.03 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.918 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.73 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.95 -41.36 62.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 110.014 179.27 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.533 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 34.7 mm-40 -63.37 -34.3 77.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.879 178.555 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.724 ' HB1' ' HG2' ' A' ' 128' ' ' LYS . . . -76.35 -42.38 45.04 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.678 177.734 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 12.1 t-160 -68.75 -24.82 64.49 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.347 -178.963 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -82.84 -46.14 13.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.21 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.76 -46.81 6.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.864 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.724 ' HG2' ' HB1' ' A' ' 124' ' ' ALA . 2.0 ptpt -96.19 179.42 5.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.616 0.722 . . . . 0.0 111.642 -178.575 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.596 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 0.5 OUTLIER -90.78 53.2 2.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.04 176.198 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.575 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.0 -72.65 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.686 -176.894 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.07 120.48 21.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.35 -179.129 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.33 141.34 31.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.685 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -71.62 -7.32 47.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.69 101.9 14.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.055 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.5 p -79.87 -20.79 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -74.37 -166.87 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.054 -179.911 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.85 40.7 0.99 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.938 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -84.0 -38.14 21.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.959 179.846 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 9.2 t -96.66 18.94 13.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -86.72 61.4 4.38 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.535 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 6.8 p -79.89 131.85 62.42 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 110.925 179.751 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -63.71 171.37 7.16 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.429 2.086 . . . . 0.0 112.256 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 2.8 t -77.55 157.4 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.026 179.92 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.27 -21.07 50.48 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.654 2.236 . . . . 0.0 112.208 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.447 HD23 ' HB1' ' A' ' 120' ' ' ALA . 1.4 mp -69.93 146.76 50.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.888 -179.976 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.55 149.28 16.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.395 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 t -104.64 -24.2 13.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.333 . . . . 0.0 110.929 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 55.24 79.59 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.128 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.94 166.57 24.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.986 -179.824 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.52 115.07 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.026 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 56.29 79.37 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.11 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 78.7 p -132.13 127.42 20.97 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.65 170.0 21.3 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.467 2.112 . . . . 0.0 112.327 179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.32 -19.75 16.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.022 179.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.9 150.78 5.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.983 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.07 25.34 4.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.008 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.0 m -91.19 157.63 17.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -97.63 107.07 37.42 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.968 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -73.27 -78.24 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.832 2.355 . . . . 0.0 112.409 -179.28 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.23 178.29 7.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.153 -179.455 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -73.48 126.58 30.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.965 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -77.74 173.85 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.01 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -93.48 166.92 12.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.034 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -84.21 -44.64 13.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.191 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.0 -16.92 64.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.201 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.76 78.93 1.46 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.49 -26.62 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.822 0.344 . . . . 0.0 110.957 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -89.58 23.68 2.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.082 -179.846 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.482 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -72.79 -51.3 6.76 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.465 -179.83 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 27' ' ' ASN . 59.3 Cg_endo -72.05 94.87 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.083 1.855 . . . . 0.0 112.324 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.89 93.33 7.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.875 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -73.23 -78.63 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.833 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 55.81 26.8 10.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.993 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mt -80.88 -66.31 0.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.871 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -91.66 171.93 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.41 129.11 37.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.986 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.495 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 38.5 mt-30 -87.44 -50.92 0.43 Allowed Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.353 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 59.8 Cg_endo -71.83 -171.99 0.75 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.167 1.911 . . . . 0.0 112.299 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -94.74 123.11 38.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.868 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.8 t -92.56 -30.22 4.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.111 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.1 m -80.63 -16.36 54.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.935 -179.823 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 11.0 ttt -96.11 40.85 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.974 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -165.94 87.85 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 56.4 91.16 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.85 144.69 34.51 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.536 2.157 . . . . 0.0 112.407 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.21 87.58 7.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.135 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.703 HG23 HG13 ' A' ' 47' ' ' VAL . 2.8 m -104.98 -163.71 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.835 179.62 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.41 ' H ' ' HB ' ' A' ' 45' ' ' VAL . 1.9 m-70 -80.04 72.98 6.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.775 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.703 HG13 HG23 ' A' ' 45' ' ' VAL . 16.7 m -103.23 171.51 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.319 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -148.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.804 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -72.25 120.33 7.71 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -97.19 171.18 8.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.849 0.357 . . . . 0.0 111.204 -179.224 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -65.11 159.58 63.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.875 179.783 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.411 ' HA ' ' HB2' ' A' ' 51' ' ' GLU . 85.1 Cg_endo -88.55 -155.87 0.9 Allowed 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.896 -1.293 . . . . 0.0 112.703 0.72 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.695 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -69.29 151.79 45.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.811 179.805 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.902 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -163.03 -177.19 5.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.771 179.442 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.08 -38.0 36.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.066 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.1 m -61.44 -45.14 95.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.489 179.333 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.695 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.46 -43.38 96.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.057 178.692 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.96 -46.2 88.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.619 179.345 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.34 -9.74 58.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.109 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.3 t -80.76 -8.29 59.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.798 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.851 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -134.16 60.06 41.85 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.076 179.77 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.746 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 53.0 Cg_exo -52.38 -51.94 10.02 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.535 2.157 . . . . 0.0 113.131 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.3 Cg_endo -95.28 16.59 0.91 Allowed 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.451 2.101 . . . . 0.0 112.606 -179.551 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.851 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 6.5 mt-30 -126.37 -94.75 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.611 -178.852 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.774 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.01 38.54 2.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.713 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.746 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -60.26 -50.2 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.515 179.432 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -120.0 38.4 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.564 179.199 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 65.2 tt0 -127.81 -56.07 1.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.361 -179.126 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.774 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.2 ptt? -74.91 1.18 13.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -178.816 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.706 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -65.09 -41.52 94.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.672 -179.457 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.022 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.04 26.67 3.39 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.563 -179.119 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -138.98 -4.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.994 0.426 . . . . 0.0 110.895 179.754 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.577 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 4.5 tpm_? -126.99 -24.41 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.987 179.864 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.645 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -74.9 -30.03 61.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.328 179.703 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.482 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.04 -54.67 4.3 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.031 -178.089 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.8 Cg_endo -65.27 -26.28 56.59 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.934 1.756 . . . . 0.0 112.028 178.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 53' ' ' LEU . 63.8 mt -81.57 -20.97 38.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.688 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 15.6 mm -69.53 -36.95 73.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.808 0.337 . . . . 0.0 110.112 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.685 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.9 mt-30 -53.41 -14.78 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 178.049 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.71 -40.42 20.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.698 178.702 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.25 -45.52 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.188 0.518 . . . . 0.0 110.142 179.26 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 9.3 m-70 -112.3 145.51 33.01 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.927 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.508 ' O ' ' HB ' ' A' ' 84' ' ' THR . 18.2 Cg_exo -30.97 -49.08 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.26 2.64 . . . . 0.0 112.456 -179.354 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.685 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 11.6 t 173.85 22.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.938 178.567 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -72.24 11.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.566 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.468 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -77.03 44.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.477 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -85.69 -10.7 75.77 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.332 177.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 88' ' ' LYS . 1.5 tptt -175.11 31.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.245 179.414 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.815 HG21 HG13 ' A' ' 115' ' ' VAL . 62.1 mt -79.58 -89.35 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 120.806 -0.357 . . . . 0.0 110.561 179.119 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.022 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.54 -38.57 60.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 179.241 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.47 -31.91 57.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.993 178.01 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.744 ' HG2' HG22 ' A' ' 96' ' ' ILE . 38.4 ttp -83.37 -23.14 32.57 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.717 -0.241 . . . . 0.0 110.446 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 90' ' ' THR . 4.6 mm? -61.92 -6.18 2.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.497 178.68 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.706 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.99 20.84 17.96 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 176.476 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.673 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -162.52 1.72 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.473 -179.327 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.96 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.06 -152.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 121.35 0.595 . . . . 0.0 111.757 -179.9 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.549 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.4 t70 -59.43 -2.2 0.3 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.262 178.256 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.584 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.3 m-80 78.55 -31.16 0.15 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.53 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -73.1 -29.54 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.02 0.438 . . . . 0.0 109.924 178.353 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.96 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -78.28 -21.84 49.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.757 177.533 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.65 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.8 tp -75.25 -25.01 57.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.902 176.999 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.2 mp -90.63 -46.34 8.34 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.286 -179.127 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -37.78 88.74 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.116 -178.926 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.835 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -60.86 -36.67 79.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.55 -179.657 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.6 mt -87.38 -6.03 58.63 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 110.518 179.639 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 58.8 mm-40 -109.5 -13.48 14.56 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.642 -175.701 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -138.3 139.11 24.26 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -176.825 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 8.2 Cg_exo -74.24 19.55 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 112.366 179.571 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.77 -26.14 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.99 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 107' ' ' SER . 0.6 OUTLIER -62.92 -41.25 99.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.58 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.902 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.08 -28.1 1.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.964 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -96.24 -65.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.076 -179.718 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 31.9 t -46.95 -29.28 1.96 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.374 . . . . 0.0 110.262 179.368 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 39.3 mmtt -80.69 -42.34 22.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.723 177.784 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.815 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -64.79 -60.07 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.154 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -49.34 -40.64 36.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.864 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.56 -33.87 64.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.908 0.385 . . . . 0.0 110.338 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.442 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.14 -21.66 64.91 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.975 178.24 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.722 HG22 HD13 ' A' ' 89' ' ' ILE . 24.2 t -67.83 -46.15 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.738 176.813 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.447 ' HB1' HD23 ' A' ' 3' ' ' LEU . . . -61.45 -32.08 72.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.575 177.283 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 12.2 t -79.41 -30.81 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.614 179.166 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.627 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -74.69 -42.02 59.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.29 179.904 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.405 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.6 mm100 -61.18 -30.66 70.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.707 178.546 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.585 ' HB1' ' HG2' ' A' ' 128' ' ' LYS . . . -72.64 -52.53 15.01 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.435 177.354 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.1 -17.02 64.69 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.505 -178.855 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -87.4 -50.51 6.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.786 0.327 . . . . 0.0 111.021 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.86 -42.46 8.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.871 -179.177 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.585 ' HG2' ' HB1' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.6 175.7 6.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.599 0.714 . . . . 0.0 111.563 -178.6 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.5 63.63 5.6 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.027 176.47 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.33 -67.84 0.29 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.301 -177.272 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.44 148.34 31.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.055 179.792 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -78.68 -177.47 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -85.32 -176.73 6.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -79.27 92.82 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.028 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 5.2 m -90.54 141.91 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -75.17 -76.03 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.38 142.62 27.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.31 85.41 0.79 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.137 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.9 t -117.26 -20.75 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.99 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.18 -51.44 2.06 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.453 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 141' ' ' VAL . 0.6 OUTLIER -71.67 134.29 84.1 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.614 0.245 . . . . 0.0 111.099 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.8 127.96 11.26 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.492 2.128 . . . . 0.0 112.359 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 p -88.37 -66.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.164 -179.916 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.07 77.98 2.66 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.575 2.183 . . . . 0.0 112.342 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.0 tp -82.55 119.61 24.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.27 41.18 2.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.6 m -89.58 93.54 9.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.79 0.328 . . . . 0.0 110.965 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -133.16 100.01 4.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.972 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -115.44 172.17 7.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.132 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -123.23 149.42 44.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -137.64 -159.3 0.94 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.036 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 45.2 p -57.19 151.43 36.11 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.969 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -81.36 -1.0 46.13 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.471 0.312 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 89.16 0.65 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.152 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -86.15 141.49 14.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.021 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -69.76 131.26 44.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 -179.844 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.89 86.1 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.021 -179.894 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -102.96 132.73 20.88 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.877 179.881 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -74.75 146.22 86.12 Favored 'Cis proline' 0 C--N 1.349 0.584 0 C-N-CA 123.565 -1.431 . . . . 0.0 112.517 0.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.96 126.03 28.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 179.936 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.99 -178.85 5.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.78 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -78.17 139.0 38.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.905 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.64 96.71 0.28 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.04 -56.4 3.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.074 -179.838 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.65 107.13 2.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.233 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.47 -76.33 1.01 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.396 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.4 t -101.99 117.88 47.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.818 0.342 . . . . 0.0 110.953 179.657 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.458 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.6 mtm-85 -74.43 83.32 1.96 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.029 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.494 ' H ' ' HD2' ' A' ' 28' ' ' PRO . 2.1 m-20 -91.79 -51.38 0.3 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.23 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.494 ' HD2' ' H ' ' A' ' 27' ' ' ASN . 66.1 Cg_endo -73.24 98.71 1.04 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.151 1.901 . . . . 0.0 112.16 179.762 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HB2' ' H ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -91.2 -84.25 0.26 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.89 -179.714 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.552 ' HG2' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -100.25 -165.63 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.949 -179.905 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.94 15.21 0.84 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.938 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HG2' ' A' ' 30' ' ' GLN . 1.1 mp -92.6 -77.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.442 ' HA ' HG13 ' A' ' 38' ' ' VAL . 7.2 m120 -104.38 74.48 1.18 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.837 -179.98 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.13 126.56 30.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.135 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.436 ' HB3' ' HA ' ' A' ' 36' ' ' PRO . 11.5 mm100 -91.69 155.63 43.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.72 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' ' 35' ' ' GLN . 3.1 Cg_exo -76.37 -53.33 0.16 OUTLIER 'Cis proline' 0 C--N 1.348 0.515 0 C-N-CA 123.941 -1.275 . . . . 0.0 112.326 0.916 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.82 131.36 35.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.049 -179.575 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.442 HG13 ' HA ' ' A' ' 33' ' ' ASN . 1.9 t -80.76 160.67 4.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.029 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.09 34.32 2.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.963 -179.89 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.78 161.11 14.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -128.67 179.1 5.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -163.61 145.34 7.43 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.097 179.892 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.11 84.29 1.52 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.595 2.197 . . . . 0.0 112.267 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.25 176.42 7.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.126 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -92.49 18.47 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.091 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.19 117.71 21.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 16.2 m -101.49 -178.26 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -90.64 -179.26 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.07 119.04 4.91 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.611 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -86.33 39.56 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 111.049 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.41 -50.76 6.01 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.378 179.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.29 176.13 0.88 Allowed 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.261 1.974 . . . . 0.0 112.542 -179.519 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.589 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -69.6 136.49 51.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.016 179.624 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -169.59 -178.72 3.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.144 178.329 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.985 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.3 -33.68 29.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.424 ' HB3' ' HE1' ' A' ' 57' ' ' MET . 0.4 OUTLIER -68.7 -47.97 65.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.793 -179.885 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.459 ' HB2' ' H ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -58.09 -37.82 75.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.491 0.662 . . . . 0.0 109.749 178.431 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.985 HD12 ' HA ' ' A' ' 55' ' ' ALA . 15.7 mt -66.08 -44.15 85.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.638 179.239 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.37 -9.67 35.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.562 178.803 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 57' ' ' MET . 40.1 m -78.94 -5.8 54.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.955 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.455 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -132.55 96.03 19.43 Favored Pre-proline 0 N--CA 1.451 -0.423 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.915 -179.291 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.607 ' O ' ' N ' ' A' ' 64' ' ' GLN . 50.6 Cg_exo -50.89 177.75 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.477 2.118 . . . . 0.0 110.263 177.002 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' C ' ' O ' ' A' ' 62' ' ' PRO . 57.5 Cg_exo -24.28 81.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.123 2.548 . . . . 0.0 112.782 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.725 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 2.9 tt0 -160.22 -83.65 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.23 -176.854 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.725 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 1.7 mm-40 -106.94 4.93 27.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.244 178.52 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.567 ' C ' HD11 ' A' ' 70' ' ' LEU . 2.3 mt-30 -57.57 -20.18 30.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.882 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.688 ' C ' HD21 ' A' ' 70' ' ' LEU . 4.8 ptmt -134.67 27.88 3.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.734 179.314 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.458 ' HB2' ' HA ' ' A' ' 65' ' ' GLU . 3.3 mm100 -135.09 -49.43 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.916 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.596 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -80.77 3.2 23.14 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -176.863 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.851 HD23 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -75.38 -35.31 61.1 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.107 0.48 . . . . 0.0 109.862 179.375 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.081 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.1 26.99 4.36 Favored Glycine 0 N--CA 1.438 -1.219 0 C-N-CA 119.847 -1.168 . . . . 0.0 112.702 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -144.34 -1.25 0.94 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.763 0.316 . . . . 0.0 111.381 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.0 -22.09 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.313 0.578 . . . . 0.0 109.972 179.118 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.699 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.09 -23.82 47.8 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.499 178.649 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.453 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -36.74 -54.63 1.67 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.438 -178.176 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.4 Cg_endo -72.1 -22.05 23.13 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.034 1.823 . . . . 0.0 112.795 -179.334 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.589 HD12 ' HB2' ' A' ' 53' ' ' LEU . 94.3 mt -89.36 -19.06 25.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.888 -178.73 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.802 HG13 ' HB ' ' A' ' 90' ' ' THR . 9.8 mm -73.79 -40.11 53.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 178.086 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.0 OUTLIER -53.89 -17.09 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.858 177.351 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.49 -37.88 35.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.868 178.732 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.702 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.25 -47.14 52.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.485 179.973 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.0 m-70 -113.33 148.97 40.74 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.622 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -56.3 79.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.433 2.088 . . . . 0.0 111.981 179.284 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.504 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 58.4 p 45.57 34.42 1.67 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.154 -178.483 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -89.7 6.95 39.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.016 -179.73 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -80.1 46.92 0.85 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.272 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.52 85.7 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.562 -0.828 . . . . 0.0 111.583 178.315 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.705 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -174.3 29.07 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.92 0.39 . . . . 0.0 110.702 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.933 HG21 HG13 ' A' ' 115' ' ' VAL . 65.8 mt -80.43 -93.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.406 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.081 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -50.67 -40.77 54.54 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.444 -178.925 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.08 -31.51 56.12 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.092 -1.051 . . . . 0.0 111.054 178.686 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.695 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.99 -22.75 28.98 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 120.846 0.355 . . . . 0.0 110.155 179.412 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.554 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.89 -5.78 2.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.851 HD11 HD23 ' A' ' 70' ' ' LEU . 5.1 mp -108.51 26.7 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.166 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.604 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.3 pt-20 -165.93 -0.21 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.314 -179.267 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.93 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.04 -152.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.366 0.603 . . . . 0.0 111.517 -179.993 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.5 t70 -59.44 -3.84 0.5 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.307 177.941 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.606 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.9 m-20 77.61 -28.73 0.17 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.356 -179.576 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -74.03 -26.55 60.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.93 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.4 OUTLIER -81.33 -26.49 35.57 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.454 176.985 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -74.96 -25.26 58.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.403 176.242 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.73 -48.43 8.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.214 -179.374 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.554 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -62.76 -42.32 99.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.091 -178.863 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.757 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.49 -33.63 66.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.303 -179.726 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.721 HD23 HD13 ' A' ' 58' ' ' LEU . 25.9 mt -86.76 -10.3 53.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.054 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.72 -8.92 15.29 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.735 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -140.72 133.38 14.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.846 -178.723 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.517 ' O ' HG21 ' A' ' 54' ' ' THR . 60.3 Cg_endo -71.4 3.71 3.41 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.595 2.196 . . . . 0.0 111.803 178.846 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -126.47 -11.09 6.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -79.06 -46.07 18.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.121 0.486 . . . . 0.0 109.704 177.989 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.54 -40.47 18.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.205 176.097 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 113' ' ' SER . 3.8 ttt180 -80.33 -57.33 3.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.375 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.417 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 42.1 t -53.71 -56.83 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.766 0.317 . . . . 0.0 110.799 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 7.6 mmtm -54.65 -32.81 59.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.933 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -72.11 -58.32 5.34 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.046 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.31 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -31.47 58.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.113 0.482 . . . . 0.0 110.29 178.552 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -79.95 -32.45 39.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.832 178.408 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.695 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.69 -20.81 63.55 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.746 177.468 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.702 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.5 t -69.48 -47.8 70.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.412 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.3 -25.58 64.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.471 177.03 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 6.2 t -86.05 -34.96 8.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.098 178.692 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.705 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -67.23 -33.3 75.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.203 178.254 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.58 -27.34 37.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.615 176.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.503 ' C ' ' HB3' ' A' ' 128' ' ' LYS . . . -89.02 8.65 28.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.368 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.43 ' C ' ' HG2' ' A' ' 128' ' ' LYS . 1.7 t60 -125.81 -31.86 2.88 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.158 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -89.35 -63.53 1.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.243 178.851 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.642 ' HB1' HG21 ' A' ' 139' ' ' THR . . . -95.24 17.03 15.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.055 -177.98 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.661 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 7.6 ptmt -71.25 -147.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.928 0.394 . . . . 0.0 110.563 178.854 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -81.07 10.31 5.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.406 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.661 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.3 -22.01 51.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.376 -178.886 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -83.77 -170.38 3.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.06 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -71.07 -76.73 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.059 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.73 ' HB3' HG23 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.48 119.67 11.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.826 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -86.84 41.54 0.97 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.181 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.73 HG23 ' HB3' ' A' ' 133' ' ' LYS . 0.2 OUTLIER -99.15 166.17 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.972 179.737 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -92.39 62.86 4.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.95 173.27 6.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.98 -179.757 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.91 141.19 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.043 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.642 HG21 ' HB1' ' A' ' 127' ' ' ALA . 13.5 p -100.83 159.93 14.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.034 -179.874 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -85.61 99.15 2.34 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.543 -179.898 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.612 ' H ' ' HD2' ' A' ' 142' ' ' PRO . 3.0 t -97.17 -51.81 0.22 Allowed Pre-proline 0 C--N 1.329 -0.298 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -179.838 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.612 ' HD2' ' H ' ' A' ' 141' ' ' VAL . 49.8 Cg_endo -68.68 165.98 27.63 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.153 1.902 . . . . 0.0 112.351 -179.896 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.9 t -104.42 144.49 31.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.948 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.087 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.53 -57.03 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.506 2.137 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.59 -75.4 0.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.901 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -106.9 178.16 22.06 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.546 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -97.35 -36.31 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.748 0.308 . . . . 0.0 110.912 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.21 116.23 28.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.986 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.6 142.25 16.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.087 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 58.45 -165.56 0.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.127 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 130.22 39.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 -179.892 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.707 ' N ' ' HA ' ' A' ' 11' ' ' PRO . 0.3 OUTLIER -81.08 -49.02 1.05 Allowed Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.744 -179.881 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.707 ' HA ' ' N ' ' A' ' 10' ' ' THR . 80.8 Cg_endo -88.49 168.77 36.61 Favored 'Cis proline' 0 C--N 1.357 1.001 0 C-N-CA 124.551 -1.021 . . . . 0.0 112.662 0.835 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.29 -59.01 2.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.149 180.0 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.423 HG22 ' H ' ' A' ' 13' ' ' VAL . 1.6 m -83.5 102.34 9.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.132 -179.907 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -98.64 125.28 43.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.838 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.0 118.04 33.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.011 -179.832 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.731 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 0.3 OUTLIER -99.88 -46.97 0.21 Allowed Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.682 -179.901 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.731 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 19.8 Cg_endo -60.52 -55.43 1.47 Allowed 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.921 1.747 . . . . 0.0 112.487 -179.804 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.95 73.05 10.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.912 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -78.7 144.28 35.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.901 179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -73.91 143.95 45.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -89.25 83.12 6.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.7 -13.27 27.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.062 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.15 9.42 20.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.045 179.907 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.31 110.55 4.04 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.492 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.79 128.77 65.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.768 0.318 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.53 99.96 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.976 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -95.12 141.75 23.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.834 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.47 -15.71 31.74 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.626 2.217 . . . . 0.0 112.315 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.67 51.55 2.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.569 ' HB3' HD23 ' A' ' 32' ' ' LEU . 6.3 mm100 -82.01 -42.77 18.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.823 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 55.74 57.9 4.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.093 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 30' ' ' GLN . 0.2 OUTLIER -90.99 88.88 7.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.786 179.7 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -97.58 -166.02 1.33 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.05 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.11 108.17 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.227 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.407 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 5.1 tt0 -106.46 93.3 8.13 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.794 179.522 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 30.1 Cg_endo -63.05 -69.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.463 2.109 . . . . 0.0 112.204 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -101.53 -178.28 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.934 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.8 p -81.71 -26.46 9.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.93 100.3 12.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.976 179.955 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.5 36.95 2.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 38.95 40.42 0.45 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.556 -179.801 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -91.86 152.72 43.31 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.871 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -90.95 115.24 2.48 Favored 'Cis proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.756 -1.352 . . . . 0.0 112.429 0.322 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -86.83 65.11 8.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.981 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.437 ' HB ' HG12 ' A' ' 47' ' ' VAL . 8.3 m -88.09 150.43 3.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.157 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -107.84 7.78 28.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.437 HG12 ' HB ' ' A' ' 45' ' ' VAL . 8.1 p -89.94 141.66 14.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.954 179.909 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 151.05 31.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 179.996 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -74.25 120.0 6.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.47 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -102.55 138.51 39.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.608 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -69.61 -49.74 20.71 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.414 179.659 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.608 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 20.6 Cg_endo -60.3 147.14 94.84 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.204 1.936 . . . . 0.0 112.234 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.775 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER -92.13 136.08 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.976 -179.561 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.861 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.98 -175.36 1.21 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.647 178.585 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.49 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.34 -45.77 55.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.591 -179.687 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.7 m -55.9 -45.45 78.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.8 0.333 . . . . 0.0 110.718 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.495 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -60.29 -42.91 96.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.377 178.964 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.68 -46.9 86.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.338 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.46 -9.48 53.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.026 179.65 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.2 t -82.22 -9.17 59.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.003 -179.615 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.876 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.98 58.52 32.18 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.419 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.595 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.1 Cg_exo -54.07 -49.84 15.7 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.531 2.154 . . . . 0.0 113.286 -179.482 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.513 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 76.5 Cg_endo -87.23 -8.05 6.66 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.151 1.901 . . . . 0.0 112.768 -179.117 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.876 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 2.6 tp60 -97.0 -79.3 0.46 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.168 -179.472 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -104.92 -93.98 0.35 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.033 -179.507 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.595 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER 74.99 -47.99 0.63 Allowed 'General case' 0 N--CA 1.465 0.285 0 O-C-N 123.524 0.515 . . . . 0.0 111.142 -179.108 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.629 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -127.15 26.33 6.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.032 179.686 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.489 ' N ' HD21 ' A' ' 70' ' ' LEU . 2.6 tt0 -128.34 -53.28 1.28 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.937 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.456 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -78.58 20.5 0.43 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.155 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.822 HD13 HD21 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -89.65 -53.43 4.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.168 0.508 . . . . 0.0 110.385 179.698 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.074 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -108.32 18.66 32.85 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.379 -0.915 . . . . 0.0 111.775 178.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.78 -10.59 2.07 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.338 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.549 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.55 -15.38 5.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.571 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.726 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -78.13 -12.67 60.01 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.526 179.968 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.4 t80 -49.64 -54.55 30.13 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.768 -177.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 26.3 Cg_exo -63.27 -7.88 13.16 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.139 1.892 . . . . 0.0 112.329 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.775 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.1 mm? -98.63 -37.46 9.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.65 -179.178 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.597 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.5 mm -61.1 -42.46 93.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-O 120.717 0.294 . . . . 0.0 110.942 -179.626 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.8 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -48.88 -18.79 0.31 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.956 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.49 -40.14 18.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.255 179.378 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.479 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.53 -35.47 68.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.347 0.594 . . . . 0.0 110.601 179.674 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.706 ' CE1' HG21 ' A' ' 119' ' ' VAL . 7.2 m170 -121.61 157.44 56.75 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.649 -177.037 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.501 ' HD2' HD13 ' A' ' 85' ' ' LEU . 16.3 Cg_exo -67.29 69.08 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.488 2.126 . . . . 0.0 111.586 179.031 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.8 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.5 OUTLIER 52.41 24.2 2.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.753 -178.252 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.501 HD13 ' HD2' ' A' ' 83' ' ' PRO . 0.0 OUTLIER -76.93 1.97 16.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.168 -179.33 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.39 -135.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.232 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.76 -17.24 11.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.97 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.953 ' HE2' ' HB2' ' A' ' 122' ' ' LEU . 0.1 OUTLIER -155.88 -20.98 0.11 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.846 HG21 HG13 ' A' ' 115' ' ' VAL . 61.2 mt -50.17 -80.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 CA-C-N 117.706 0.23 . . . . 0.0 111.397 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.074 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.1 -40.22 67.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.557 0.217 . . . . 0.0 110.88 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.95 -28.77 61.22 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.581 176.836 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.645 ' HE3' ' HB1' ' A' ' 118' ' ' ALA . 3.3 ttm -75.65 -37.0 60.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 121.474 0.654 . . . . 0.0 109.83 177.35 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.717 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.06 -9.63 0.66 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.72 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.611 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.24 27.09 8.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.363 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.8 pt-20 -170.19 1.26 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.758 -178.477 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.982 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.99 -148.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 121.436 0.636 . . . . 0.0 111.42 -179.768 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 3.3 t70 -54.38 -9.82 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.799 175.929 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.702 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.6 m120 79.43 -24.1 0.22 Allowed 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.41 -0.813 . . . . 0.0 111.164 -179.696 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -75.51 -28.47 59.15 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.564 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.982 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.42 -33.91 63.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.007 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.3 -27.73 68.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.194 178.445 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.602 HD12 HD23 ' A' ' 101' ' ' LEU . 2.7 mp -85.58 -48.33 9.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -39.06 90.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.501 -178.527 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.866 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -57.45 -37.49 72.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.37 -179.365 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.822 HD21 HD13 ' A' ' 70' ' ' LEU . 6.6 mt -87.5 -8.52 56.31 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.115 0.483 . . . . 0.0 110.293 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -106.47 -8.4 17.12 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.267 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.791 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.95 133.48 11.61 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.63 0.252 . . . . 0.0 111.557 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.499 ' O ' HG21 ' A' ' 54' ' ' THR . 51.2 Cg_endo -69.29 3.44 2.54 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.692 2.261 . . . . 0.0 112.207 179.46 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.17 -26.0 3.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.23 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.76 -44.1 94.44 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.223 179.743 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.866 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -47.43 -41.24 19.8 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.471 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 112' ' ' ARG . 1.6 ttt180 -79.09 -64.15 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 t -49.18 -54.07 18.2 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.717 0.294 . . . . 0.0 111.134 -178.901 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.427 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 5.4 mmtt -59.38 -28.95 67.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.091 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.846 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -71.85 -58.41 5.17 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 178.142 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.433 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.8 t70 -51.24 -36.69 43.09 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.864 0.364 . . . . 0.0 110.869 178.089 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.74 -40.17 69.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.477 179.015 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.645 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.39 -29.82 70.76 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.931 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.706 HG21 ' CE1' ' A' ' 82' ' ' HIS . 22.4 t -55.49 -50.62 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-O 121.387 0.613 . . . . 0.0 109.822 177.387 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.51 -29.16 34.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.763 177.442 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.484 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 12.3 t -84.6 -31.65 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.898 179.13 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.953 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.36 -43.17 74.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.958 179.503 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.503 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.3 mm-40 -65.37 -30.33 71.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.887 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.469 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -88.65 -1.45 58.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.315 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.484 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 12.2 t-80 -120.68 -9.73 9.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.64 -178.675 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -65.14 -105.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.929 -179.354 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.3 36.05 1.27 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 111.152 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -96.16 -152.63 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.067 -179.773 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.86 8.23 13.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.79 179.826 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.424 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . . . -88.62 2.01 53.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.914 179.821 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -88.68 100.23 12.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.989 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.446 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.5 OUTLIER -82.83 78.18 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.862 -179.75 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.02 -65.48 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.872 179.845 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.53 91.61 4.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.069 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.0 t -73.93 132.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.073 -179.748 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -92.21 -58.35 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.853 179.799 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 2.7 m -88.27 113.94 24.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.664 179.486 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.65 86.95 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 102.14 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -80.67 -14.31 80.03 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.555 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.5 130.8 32.52 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 120.607 0.242 . . . . 0.0 111.006 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.59 71.45 5.98 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.456 2.104 . . . . 0.0 112.344 -179.954 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 2.5 t -97.89 -34.53 10.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.985 -179.674 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.987 -179.872 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.46 121.89 9.05 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.529 2.153 . . . . 0.0 112.188 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.492 ' H ' ' HG ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -98.52 49.21 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.861 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.88 -173.56 24.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.456 179.824 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -79.21 161.37 26.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.774 0.321 . . . . 0.0 110.968 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.3 123.4 23.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.144 -179.902 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.53 17.89 0.54 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.023 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -139.03 9.16 2.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -130.91 -70.76 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.13 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m 57.52 91.18 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.169 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.72 111.13 2.93 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.461 2.107 . . . . 0.0 112.278 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.63 -49.9 9.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.7 m -89.41 162.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.106 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.09 122.73 23.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 52.1 p -90.31 122.36 33.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.1 t -94.14 130.21 34.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.951 179.78 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.23 -179.21 1.36 Allowed 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.534 2.156 . . . . 0.0 112.249 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.78 135.02 38.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.008 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -148.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.65 179.592 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -162.71 0.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.745 0.307 . . . . 0.0 110.853 179.901 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -63.7 97.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.942 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.91 -169.52 1.89 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.174 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.47 167.27 21.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.86 68.4 2.56 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.515 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.8 m -100.39 77.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.964 0.412 . . . . 0.0 111.114 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 137.53 52.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.997 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.688 ' N ' ' HA ' ' A' ' 28' ' ' PRO . 0.6 OUTLIER -74.09 -49.81 5.49 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.602 179.934 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.688 ' HA ' ' N ' ' A' ' 27' ' ' ASN . 92.0 Cg_endo -90.13 -44.91 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 124.571 -1.012 . . . . 0.0 112.843 0.665 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -79.82 140.64 36.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -71.22 164.83 24.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -123.1 46.58 2.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.981 -179.737 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.66 -16.18 20.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.886 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -82.03 -164.96 0.88 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.89 -167.49 0.2 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.743 ' H ' ' HA ' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -90.7 -50.95 0.33 Allowed Pre-proline 0 CA--C 1.536 0.433 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.612 -179.818 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.743 ' HA ' ' H ' ' A' ' 35' ' ' GLN . 67.7 Cg_endo -94.27 -163.97 1.26 Allowed 'Cis proline' 0 C--N 1.355 0.888 0 C-N-CA 124.723 -0.949 . . . . 0.0 112.684 0.658 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -71.01 126.65 30.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.977 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.9 t -76.51 90.62 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.029 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.82 103.14 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 179.98 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -89.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.998 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 112.99 2.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.028 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -64.84 146.62 98.61 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.019 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.29 86.66 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.0 112.233 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.56 145.59 36.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.143 -179.83 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 t -98.67 81.72 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.067 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -107.92 0.56 22.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.927 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.94 155.84 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.017 -179.917 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.24 35.0 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -77.03 -30.64 55.23 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.496 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -105.83 149.01 26.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.99 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -73.28 124.46 90.56 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.031 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' MET . 34.3 Cg_exo -62.25 150.4 87.12 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.684 2.256 . . . . 0.0 112.399 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.671 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -72.14 135.94 46.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.121 179.725 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.869 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.42 -178.2 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.325 178.026 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.939 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.19 -38.39 39.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.645 -179.134 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.684 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.0 OUTLIER -64.1 -48.91 74.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.843 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.684 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.13 -40.23 80.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.296 0.569 . . . . 0.0 110.357 179.377 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.939 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.3 mt -64.08 -45.0 90.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.98 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.82 -7.66 29.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.567 178.792 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.444 ' HB3' ' O ' ' A' ' 57' ' ' MET . 21.5 t -83.77 -5.23 59.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.768 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.58 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.05 56.85 23.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.353 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.623 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 51.5 Cg_exo -54.56 -52.65 7.65 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.432 2.088 . . . . 0.0 113.225 -179.082 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 66.7 Cg_endo -96.15 21.91 0.42 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.501 2.134 . . . . 0.0 112.544 -179.329 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.556 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 23.5 mt-30 -130.72 -98.0 0.33 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.629 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.665 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -104.6 38.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.676 -177.964 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.608 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.54 -30.68 71.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.297 178.594 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.729 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -129.92 40.21 3.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.407 179.3 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.418 ' N ' HD21 ' A' ' 70' ' ' LEU . 52.0 tt0 -138.01 -52.71 0.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.972 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.665 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 3.7 ptt? -81.7 6.52 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -176.942 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 1.034 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -63.05 -59.08 5.28 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.257 0.551 . . . . 0.0 110.2 -179.82 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.011 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -116.91 32.53 5.44 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.201 -1.0 . . . . 0.0 112.697 -179.183 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -141.09 -1.06 1.4 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.733 0.301 . . . . 0.0 111.27 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.26 -23.04 3.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.092 0.472 . . . . 0.0 110.057 179.343 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.708 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.5 -22.42 54.5 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.663 178.62 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -40.09 -55.26 4.02 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.241 -177.952 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 59.5 Cg_endo -72.4 -16.04 27.8 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.04 1.826 . . . . 0.0 112.596 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.671 HD12 ' HB2' ' A' ' 53' ' ' LEU . 50.6 mt -92.84 -21.1 20.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.603 -179.136 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.74 HG13 ' HB ' ' A' ' 90' ' ' THR . 10.3 mm -73.15 -38.94 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.743 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 0.2 OUTLIER -52.08 -17.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.04 177.724 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -78.17 -39.38 41.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.864 178.663 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.689 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -71.42 -45.01 63.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.538 -179.96 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 5.4 m-70 -115.45 139.95 25.28 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.382 -179.979 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -50.5 82.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.53 2.154 . . . . 0.0 112.147 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.743 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 73.5 p 43.72 40.04 2.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.163 -178.837 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -97.17 6.28 48.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.183 -179.477 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -81.07 56.31 2.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.106 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.91 -8.56 75.83 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.151 177.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.634 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.2 tptt -177.65 31.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.394 179.737 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.882 HG21 HG13 ' A' ' 115' ' ' VAL . 80.9 mt -79.66 -89.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.981 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.011 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -51.66 -42.46 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.448 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.47 -30.65 50.32 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.014 -1.089 . . . . 0.0 110.919 178.665 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.638 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -83.8 -23.58 31.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.452 -0.374 . . . . 0.0 110.199 178.941 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.57 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.2 mm? -60.72 -10.61 5.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.91 179.052 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.034 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.5 mp -105.68 27.17 8.7 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 176.755 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.638 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -166.03 -0.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.699 -178.993 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 1.016 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.44 -150.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.508 0.67 . . . . 0.0 111.727 -179.389 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.606 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -55.09 -8.43 0.28 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.851 175.896 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.764 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 80.08 -31.13 0.13 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.942 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.94 -29.17 68.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.834 178.44 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 1.016 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -76.08 -34.96 59.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.757 177.255 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.752 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -64.62 -30.15 71.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.913 178.263 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.67 -47.75 11.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.362 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.0 OUTLIER -64.79 -42.2 95.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.494 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.75 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.17 -34.9 66.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.505 -179.123 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.677 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.8 mt -85.84 -11.04 54.39 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.937 -179.544 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 1.5 pt-20 -109.53 -4.83 15.99 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.113 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -143.56 133.52 11.92 Favored Pre-proline 0 C--N 1.331 -0.207 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.948 -179.245 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 54' ' ' THR . 12.8 Cg_exo -70.73 1.13 5.38 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.98 2.453 . . . . 0.0 111.946 179.316 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.551 ' O ' ' HB2' ' A' ' 113' ' ' SER . 76.7 mt-10 -125.56 -11.48 6.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.537 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.04 -44.98 24.88 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.142 0.496 . . . . 0.0 109.733 177.908 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.869 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.77 -41.92 24.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.25 176.07 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.66 -61.14 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.551 -179.499 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.551 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.96 -53.23 20.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.809 0.338 . . . . 0.0 111.224 -178.895 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.68 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 71.4 mmtt -60.59 -29.74 69.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.018 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.882 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.81 -56.01 11.65 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.253 178.774 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.428 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -53.88 -35.36 61.49 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 110.512 178.761 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -38.88 63.29 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.28 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.36 -22.56 66.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.759 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.1 t -68.37 -49.01 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-O 121.084 0.469 . . . . 0.0 109.831 177.022 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.46 -27.17 65.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.389 177.149 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.5 t -83.88 -30.8 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.464 179.097 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -76.07 -33.52 59.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.824 178.804 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -67.54 -33.43 75.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.862 178.442 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 128' ' ' LYS . . . -77.48 -76.62 0.17 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.549 177.8 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.414 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.4 OUTLIER -29.34 -39.77 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.91 0.756 . . . . 0.0 112.47 -177.836 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 124' ' ' ALA . 24.9 mm100 -64.57 -80.3 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.292 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.39 30.35 2.57 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.371 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.878 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -96.14 -158.31 0.65 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 0.0 111.043 178.793 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.71 20.58 2.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.582 177.161 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.878 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -60.65 -32.72 71.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.208 -178.474 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.31 100.35 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.272 -179.373 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.45 ' HG3' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -97.61 34.99 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.666 179.515 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.34 172.81 1.78 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.12 -179.866 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -85.5 -166.91 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 17.0 m -75.35 155.31 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.14 -179.905 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.426 ' HB3' ' H ' ' A' ' 137' ' ' SER . 9.3 m-80 -84.14 -111.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.789 -179.99 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.426 ' H ' ' HB3' ' A' ' 136' ' ' ASN . 0.3 OUTLIER -103.9 114.08 28.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.804 0.335 . . . . 0.0 110.892 179.973 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -75.86 151.27 37.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.054 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.7 t -88.54 148.68 24.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.932 179.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -103.61 -151.09 22.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.8 m -84.55 146.49 47.16 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.466 0.174 . . . . 0.0 111.126 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 144' ' ' VAL . 88.6 Cg_endo -80.82 178.9 30.35 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.443 -1.482 . . . . 0.0 112.445 0.126 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.11 14.55 29.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.925 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.574 HG22 ' HB2' ' A' ' 142' ' ' PRO . 6.1 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.045 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -60.3 159.7 25.93 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.668 2.245 . . . . 0.0 112.195 -179.838 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.5 110.72 22.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.931 179.889 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.1 -161.99 27.64 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.482 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.43 21.44 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.799 0.333 . . . . 0.0 111.119 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.07 -160.07 0.24 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.148 179.841 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.55 -2.4 0.14 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.234 -179.815 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.72 -59.29 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.151 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 59.92 -172.69 0.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.19 -179.729 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.58 135.05 26.93 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.038 -179.82 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 100.18 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.665 2.243 . . . . 0.0 112.212 -179.906 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.7 7.71 16.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.082 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -90.78 139.88 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 -179.88 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.32 104.17 10.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.905 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.7 p -104.56 95.92 6.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.021 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.41 109.69 45.89 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.825 179.674 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.7 101.94 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.638 2.225 . . . . 0.0 112.373 -179.489 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -96.35 62.74 2.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.762 179.594 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -69.55 -163.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.194 -179.563 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -72.2 164.18 26.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.999 -179.794 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -90.12 -15.8 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.923 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.05 -74.69 0.25 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.105 -179.868 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.9 55.78 3.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.069 -179.95 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.42 -63.29 0.69 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.582 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.34 97.55 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 111.097 179.922 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.0 tpt85 -91.89 -11.69 35.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 179.844 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.419 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 4.1 p-10 -94.87 131.74 29.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 179.884 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 27' ' ' ASN . 27.1 Cg_exo -62.35 -14.18 37.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.715 2.277 . . . . 0.0 112.198 -179.717 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -77.79 103.05 7.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.92 -179.904 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -99.66 -14.15 19.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.946 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 55.74 44.91 25.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.809 -179.906 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mt -85.77 160.74 19.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.879 179.885 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -101.99 160.58 14.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.906 -179.843 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 128.44 35.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 -179.873 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -99.98 140.48 21.55 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.995 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.04 -10.59 15.19 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.202 . . . . 0.0 112.288 179.941 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -80.78 -165.65 0.94 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.574 HG12 ' H ' ' A' ' 40' ' ' MET . 2.1 t -77.89 138.88 19.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.097 -179.777 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.71 -6.75 51.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.901 -179.948 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.574 ' H ' HG12 ' A' ' 38' ' ' VAL . 2.9 ttt -89.61 90.57 8.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.87 127.48 56.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.975 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.555 ' H ' ' HD2' ' A' ' 43' ' ' PRO . 60.5 mt-30 -93.76 -51.26 0.26 Allowed Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.397 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.555 ' HD2' ' H ' ' A' ' 42' ' ' GLN . 57.9 Cg_endo -70.83 86.27 0.74 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.119 1.88 . . . . 0.0 112.356 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.19 134.03 38.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -86.82 13.34 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -98.75 -7.52 27.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.971 179.985 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.0 t -107.03 39.12 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.971 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -87.22 8.93 21.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.916 179.952 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -90.41 18.9 46.88 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.436 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -97.23 138.11 35.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.806 0.336 . . . . 0.0 110.999 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 15.3 mt-10 -85.31 130.67 50.79 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 51' ' ' GLU . 32.5 Cg_exo -59.66 128.81 28.32 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.558 2.172 . . . . 0.0 112.211 -179.988 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -81.72 136.26 35.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.816 179.844 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.775 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -167.83 179.37 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.372 179.521 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.625 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -46.5 -44.51 17.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.664 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -46.64 82.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.729 179.921 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.509 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.09 -42.36 85.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.898 178.565 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.556 HD22 ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -61.12 -42.23 98.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.417 178.583 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -17.29 48.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.507 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.9 t -69.7 -22.05 63.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.117 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.895 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . . . -133.17 65.93 74.3 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.838 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.627 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.9 Cg_exo -53.56 -52.36 8.75 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.652 2.235 . . . . 0.0 113.204 -178.668 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.617 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.4 Cg_endo -96.34 23.02 0.36 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.506 2.138 . . . . 0.0 112.451 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.883 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 15.9 mm-40 -132.29 -88.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.878 -178.455 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.895 ' HG2' ' HB3' ' A' ' 61' ' ' ALA . 1.1 pt-20 -106.92 33.56 3.89 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.983 0.421 . . . . 0.0 111.682 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.627 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -75.71 -27.82 58.36 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.028 179.318 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.558 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -126.85 31.01 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 -179.607 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.516 ' N ' HD21 ' A' ' 70' ' ' LEU . 30.2 tt0 -132.46 -55.93 0.96 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.712 -179.523 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.816 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 2.8 ptt? -80.9 28.12 0.36 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.563 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -89.87 -47.38 7.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.24 0.543 . . . . 0.0 109.956 178.834 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -110.79 12.62 29.78 Favored Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 177.658 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -127.51 0.53 6.24 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.466 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.734 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.49 -31.56 2.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.787 -0.188 . . . . 0.0 111.325 -179.706 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.849 HD22 HD12 ' A' ' 53' ' ' LEU . 2.9 mm? -57.62 -27.15 62.52 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.127 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' CD ' ' A' ' 76' ' ' PRO . 9.2 t80 -38.41 -62.12 0.75 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.003 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.656 ' HG2' HD22 ' A' ' 77' ' ' LEU . 30.0 Cg_endo -62.19 -14.81 40.29 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.897 1.731 . . . . 0.0 112.312 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.709 ' HG ' ' H ' ' A' ' 53' ' ' LEU . 2.1 mm? -96.73 -25.99 15.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.866 -178.685 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' A' ' 74' ' ' LEU . 7.3 mm -70.88 -46.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 CA-C-O 120.845 0.355 . . . . 0.0 110.758 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.944 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 21.4 mt-30 -50.11 -19.22 0.7 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.543 178.876 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.61 -37.71 27.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.961 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.5 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.87 -37.27 62.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.757 -179.838 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -124.49 150.62 65.19 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.605 -179.526 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.27 79.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.438 2.092 . . . . 0.0 111.641 179.036 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.944 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 13.1 t 40.35 36.62 0.36 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.368 -178.3 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -86.13 2.63 45.99 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.072 -179.87 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.588 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.75 -141.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.403 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.66 -7.16 59.22 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.816 -179.132 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.656 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.8 OUTLIER -161.98 -25.24 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.748 -0.226 . . . . 0.0 111.527 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.764 HG21 HG13 ' A' ' 115' ' ' VAL . 61.8 mt -49.14 -81.97 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -178.39 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.74 -37.21 70.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.821 -179.828 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.72 -28.33 56.69 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 177.032 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.583 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.23 -34.67 55.93 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.33 0.586 . . . . 0.0 109.797 177.17 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.726 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -58.27 -9.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.591 -178.264 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.476 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.5 mm? -104.31 26.75 8.51 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.751 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -171.36 1.03 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.031 -178.274 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.999 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.66 -148.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.466 0.651 . . . . 0.0 111.696 -179.239 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.605 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.6 t0 -54.24 -9.67 0.3 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.863 176.167 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.691 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.7 m120 79.66 -22.07 0.3 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -78.29 -25.33 46.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.058 0.456 . . . . 0.0 109.791 177.407 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.999 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -78.72 -25.44 44.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.817 177.327 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.702 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.9 tp -74.66 -27.24 60.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.094 178.491 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.48 -45.67 9.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.829 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.408 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.7 t-80 -62.85 -47.03 85.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.166 -178.92 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.877 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.1 ptm -52.59 -35.71 54.74 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.536 -178.779 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.73 HD21 HD13 ' A' ' 70' ' ' LEU . 25.1 mt -83.57 -11.92 56.75 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.963 -178.695 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -108.33 -11.56 15.18 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.715 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.478 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.15 137.05 17.53 Favored Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.981 -178.941 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 6.5 Cg_exo -73.63 2.22 6.07 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.941 2.427 . . . . 0.0 111.923 179.433 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -121.42 -16.01 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.546 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.478 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 3.3 p -74.66 -51.22 14.98 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.007 0.432 . . . . 0.0 109.859 178.612 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.877 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.1 OUTLIER -46.78 -38.77 10.61 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.319 177.429 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.412 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 16.1 ttt180 -81.05 -65.42 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.242 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.411 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 74.9 m -47.63 -54.5 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.785 0.326 . . . . 0.0 111.22 -178.936 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.428 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 9.0 mmtt -58.89 -33.06 70.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.132 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.764 HG13 HG21 ' A' ' 89' ' ' ILE . 1.3 t -70.61 -55.03 15.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -40.1 60.63 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.89 178.174 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -73.58 -34.9 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.24 178.936 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 121' ' ' VAL . . . -66.6 -24.15 66.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.961 178.016 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -63.5 -51.46 70.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 176.61 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.6 -24.67 34.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.538 176.997 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 34.7 t -84.63 -32.83 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.924 179.489 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.656 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.71 -44.23 62.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.023 179.294 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.551 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.0 mm-40 -63.73 -29.5 70.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.986 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.612 ' HB1' ' HE3' ' A' ' 128' ' ' LYS . . . -75.78 -50.74 14.36 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.949 178.276 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -69.15 -18.5 63.95 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.722 -178.289 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -87.65 -45.96 9.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.826 0.346 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.85 -47.43 6.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.731 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.612 ' HE3' ' HB1' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.13 178.89 5.25 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.708 0.766 . . . . 0.0 111.754 -178.199 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 3.7 pt-20 -90.49 61.82 5.06 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.924 175.84 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.464 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -57.63 -23.27 50.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.503 -177.209 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.76 99.03 6.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.98 179.6 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -78.71 -179.73 6.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -89.71 44.42 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.054 179.976 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.08 172.86 7.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 25.2 m -80.48 -169.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.059 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.89 150.58 48.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 179.726 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.91 178.58 6.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.84 77.35 8.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.165 179.959 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.79 -51.69 2.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.946 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -105.08 79.05 0.28 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 4.9 p -94.19 131.22 31.93 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.593 0.235 . . . . 0.0 111.041 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.19 103.63 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.476 2.117 . . . . 0.0 112.258 -179.807 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.56 108.38 19.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 -179.97 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 10.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.086 179.921 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.67 -78.78 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.529 2.152 . . . . 0.0 112.316 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp -100.07 -30.81 11.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.87 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.2 111.68 3.56 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.453 -179.963 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -102.3 41.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.821 0.343 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.81 -167.54 0.13 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.227 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.38 -54.19 4.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.07 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.08 -169.95 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.86 -175.97 3.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.064 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.56 94.03 26.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.901 179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -68.77 127.37 15.29 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.427 2.085 . . . . 0.0 112.26 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.7 -25.99 14.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.912 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.4 111.97 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -100.17 136.86 39.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.999 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t -109.03 137.53 46.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 p -116.7 129.13 25.51 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.56 176.61 35.32 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.959 -1.267 . . . . 0.0 112.16 0.525 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -100.03 75.59 1.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.727 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -69.07 -23.76 64.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.17 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.14 158.94 15.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.083 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.53 93.58 9.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.788 179.83 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.15 -65.26 1.02 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.067 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.33 131.34 41.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.166 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.03 46.86 3.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.398 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.16 179.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.862 0.363 . . . . 0.0 110.995 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -91.04 -71.19 0.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.859 179.984 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -92.6 131.0 35.12 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.843 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.09 -49.03 17.88 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.557 2.171 . . . . 0.0 112.302 -179.818 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -95.75 81.54 3.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.875 -179.973 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.403 ' HB3' ' H ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -92.35 -81.71 0.34 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.68 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.403 ' H ' ' HB3' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -118.91 -12.31 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.965 -179.88 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -76.55 123.76 26.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.965 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.59 142.03 30.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.01 -179.992 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.59 -173.89 3.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.145 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.413 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 0.5 OUTLIER -96.32 108.07 39.51 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.753 179.871 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 33.0 Cg_endo -63.93 128.19 21.32 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.489 2.126 . . . . 0.0 112.3 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.69 -171.55 2.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.055 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -77.39 -14.24 14.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.7 60.09 5.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.838 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 36.4 mmm -88.72 -169.94 2.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 -179.846 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.92 126.86 30.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.991 -179.759 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.421 ' HA ' ' C ' ' A' ' 43' ' ' PRO . 5.4 pt20 -153.65 130.66 5.83 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 179.752 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.421 ' C ' ' HA ' ' A' ' 42' ' ' GLN . 15.2 Cg_exo -69.69 143.88 74.97 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.748 -1.355 . . . . 0.0 112.297 0.642 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.17 171.47 11.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.151 -179.729 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 4.3 m -101.46 2.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.198 -179.982 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.6 92.13 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.432 ' HB ' ' H ' ' A' ' 48' ' ' GLN . 12.3 m -102.21 -158.52 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.808 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.432 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 0.1 OUTLIER -68.03 -33.47 74.64 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.6 179.736 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.8 140.75 14.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.352 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -97.34 141.68 30.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 0.0 110.96 179.936 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.61 144.98 98.89 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.417 ' HA ' HD13 ' A' ' 77' ' ' LEU . 56.4 Cg_endo -70.58 -168.47 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.495 2.13 . . . . 0.0 112.402 -179.867 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.826 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -96.05 152.14 18.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.963 -179.751 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.571 HG21 ' O ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -168.36 -167.16 0.77 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.106 178.658 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 1.079 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.75 -34.5 65.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.51 -178.894 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 75.2 m -65.0 -51.54 61.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.646 179.569 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.658 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.1 -38.23 76.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.278 179.219 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.079 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.2 mt -63.03 -44.64 95.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.575 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.0 -15.99 38.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.96 179.736 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 t -72.76 -5.95 41.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 179.562 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.57 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -132.94 61.1 54.22 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.088 179.891 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.574 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 36.1 Cg_exo -58.59 -52.45 5.39 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.567 2.178 . . . . 0.0 113.575 -178.783 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.574 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 68.7 Cg_endo -89.91 -14.17 2.41 Favored 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.254 1.97 . . . . 0.0 112.951 -178.758 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.57 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 7.3 mm100 -86.07 -81.05 0.22 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.176 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.653 ' HB3' ' HB3' ' A' ' 68' ' ' GLN . 2.7 mm-40 -103.6 -94.43 0.32 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.107 -179.502 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.464 ' H ' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER 69.03 -17.32 0.21 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.946 0.403 . . . . 0.0 111.146 -178.918 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.666 ' CA ' HD21 ' A' ' 70' ' ' LEU . 1.8 mttt -136.62 11.16 3.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.291 178.915 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.653 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.8 tt0 -120.39 -56.55 1.97 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.681 -179.193 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.466 ' HB3' ' HB2' ' A' ' 73' ' ' ARG . 42.8 mtm -60.82 -7.92 2.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -177.572 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.666 HD21 ' CA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -64.73 -48.76 73.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.124 0.488 . . . . 0.0 110.204 -179.124 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.121 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -117.85 14.39 12.76 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.732 178.488 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -128.01 1.58 5.92 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.691 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.53 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.6 tpt180 -126.38 -34.6 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.244 -0.183 . . . . 0.0 110.897 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.758 ' HB3' HD11 ' A' ' 78' ' ' ILE . 3.0 mm? -59.14 -35.25 73.17 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 178.807 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.504 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.0 t80 -35.19 -61.68 0.48 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -174.533 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 33.8 Cg_endo -63.87 -16.86 57.27 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.057 1.838 . . . . 0.0 112.528 -178.972 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.826 HD12 ' HB2' ' A' ' 53' ' ' LEU . 52.4 mt -98.53 -23.95 15.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.799 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.758 HD11 ' HB3' ' A' ' 74' ' ' LEU . 1.6 mm -69.18 -35.78 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-O 120.97 0.414 . . . . 0.0 110.214 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.78 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.1 mt-30 -53.29 -17.32 1.71 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.26 -38.83 20.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.832 178.941 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.2 -44.85 67.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.126 0.489 . . . . 0.0 110.436 179.549 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -115.75 155.03 48.09 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.227 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.23 75.56 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.47 2.113 . . . . 0.0 111.994 179.538 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.78 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 30.3 p 47.17 45.85 16.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.213 -179.318 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 2.4 mp -103.39 9.09 38.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.073 -179.636 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -71.39 20.95 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.973 -179.219 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -48.64 -27.35 6.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 178.805 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 92' ' ' MET . 5.0 ttpt -171.9 40.41 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.154 178.823 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.778 HG21 HG13 ' A' ' 115' ' ' VAL . 47.8 mt -79.84 -83.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.649 178.684 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.121 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.5 -35.9 63.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.418 179.01 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.02 -30.2 60.19 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.219 -1.153 . . . . 0.0 110.219 176.38 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.586 ' HE1' ' O ' ' A' ' 118' ' ' ALA . 3.2 ttp -75.14 -36.11 61.61 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.031 -0.585 . . . . 0.0 109.882 176.451 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.9 -3.7 0.59 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.582 -177.656 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 101' ' ' LEU . 4.0 mp -109.2 26.16 10.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 175.669 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -170.86 3.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.34 -178.384 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.82 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.4 -150.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 121.483 0.659 . . . . 0.0 111.619 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.6 t70 -59.58 -2.76 0.38 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.108 177.356 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.634 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.2 m120 77.99 -31.56 0.16 Allowed 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.208 -179.651 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.98 78.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.297 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.82 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.5 mt-10 -68.18 -43.91 77.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.367 177.388 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.731 HD23 HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -54.76 -21.83 12.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.804 0.335 . . . . 0.0 110.711 177.316 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.731 HD12 HD23 ' A' ' 101' ' ' LEU . 2.5 mp -92.92 -45.12 8.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.735 -179.197 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.1 OUTLIER -70.24 -30.25 67.27 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.708 -177.839 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.76 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 0.5 OUTLIER -65.19 -34.51 78.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.632 0.253 . . . . 0.0 110.78 179.846 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.747 HD23 HD13 ' A' ' 58' ' ' LEU . 5.7 mt -87.13 -12.14 47.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.167 0.508 . . . . 0.0 110.052 178.266 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 21.5 mm-40 -105.69 -4.72 20.67 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.083 -176.16 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.909 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.2 t -149.03 133.14 8.76 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.555 -179.415 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.571 ' O ' HG21 ' A' ' 54' ' ' THR . 74.4 Cg_endo -74.55 8.93 2.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.586 2.191 . . . . 0.0 112.358 179.723 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -133.89 -20.51 1.97 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.11 -179.882 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.909 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.2 OUTLIER -64.55 -53.31 49.98 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.208 0.528 . . . . 0.0 109.784 177.73 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 10.0 tt -47.64 -35.36 9.25 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.175 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -86.63 -52.1 5.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.1 m -52.7 -50.13 63.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.663 -178.019 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.76 ' NZ ' ' HB3' ' A' ' 104' ' ' MET . 0.4 OUTLIER -80.4 -25.65 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.946 -178.533 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.778 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -59.9 -51.34 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.594 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.23 -34.42 70.42 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.434 177.467 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -77.18 -27.34 53.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.719 178.331 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.586 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -71.98 -27.74 62.96 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.224 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 16.4 t -58.2 -51.35 72.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.752 176.01 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.53 -28.53 31.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.797 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.52 -31.03 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.99 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.473 HD22 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -69.57 -41.75 75.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.9 179.094 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 82.4 mm-40 -72.49 -24.43 61.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.224 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.35 -6.83 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.189 179.427 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.749 ' HA ' ' HB3' ' A' ' 128' ' ' LYS . 3.9 t60 -113.45 -29.88 7.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.202 -179.481 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -58.72 -75.84 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.825 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -93.23 53.53 1.95 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.848 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.749 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . 19.1 pttm -64.95 112.78 3.46 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.043 -175.225 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -86.94 11.75 12.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.215 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -81.41 19.16 1.02 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.381 -179.088 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -82.02 16.52 1.88 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 179.771 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.51 163.24 23.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.22 96.13 8.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.902 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -73.0 122.32 21.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.046 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.77 144.13 11.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.968 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -83.81 77.11 9.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.048 -179.834 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.52 162.93 13.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.9 -26.15 64.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.301 -179.48 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 4.6 t -103.7 142.62 34.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.036 -179.843 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -107.05 -147.04 13.58 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.47 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 3.5 m -98.89 129.95 28.66 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.562 0.22 . . . . 0.0 111.031 179.839 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -80.61 42.31 1.31 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.586 2.191 . . . . 0.0 112.532 -179.772 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.98 13.78 33.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.83 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.141 -179.896 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -80.57 47.68 2.64 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 -179.66 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.8 mt -84.62 -65.87 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.982 179.92 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.78 -36.22 5.36 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.588 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 m -91.22 84.29 5.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.857 0.36 . . . . 0.0 110.947 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.21 100.43 12.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -98.07 69.98 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.103 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 57.71 -168.28 0.12 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.166 -179.994 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -129.0 34.85 4.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.135 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.01 132.86 18.37 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.887 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.19 139.38 38.59 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.475 2.117 . . . . 0.0 112.209 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.54 -17.0 56.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.04 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.0 t -102.98 87.01 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.16 136.45 36.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.944 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -103.18 146.4 28.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.991 179.887 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 m -104.97 137.26 19.16 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.118 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.58 -3.4 13.4 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.512 2.141 . . . . 0.0 112.316 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -75.58 149.93 38.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.864 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -74.97 167.92 20.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.901 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -102.65 118.92 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -69.42 147.11 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.14 95.23 3.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.009 179.989 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.99 105.26 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.082 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -93.49 89.21 1.29 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.618 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.464 HG23 ' H ' ' A' ' 26' ' ' ARG . 0.2 OUTLIER -104.66 -57.45 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.335 . . . . 0.0 111.012 179.641 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.464 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.8 OUTLIER -98.5 177.04 5.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.867 179.835 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.504 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 3.6 m120 -88.35 -51.73 0.39 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.368 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 27' ' ' ASN . 16.7 Cg_exo -67.88 83.4 0.43 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.381 2.054 . . . . 0.0 112.066 179.984 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -90.37 -45.2 9.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.946 -179.922 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.02 174.3 9.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.936 179.935 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -133.01 62.33 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.901 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.28 134.57 34.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.915 179.912 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -94.1 -172.71 2.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.89 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.75 122.97 24.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.872 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.634 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 4.9 mm-40 -100.69 -52.04 0.18 Allowed Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.385 -179.971 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.634 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 29.7 Cg_exo -61.72 125.23 16.17 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.182 1.922 . . . . 0.0 112.164 -179.923 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -88.2 153.32 21.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.4 m -89.62 -32.25 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.274 -179.608 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.14 111.01 22.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.4 mtt -91.15 -26.01 19.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.746 179.596 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 58.85 177.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.346 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.458 ' H ' ' CD ' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -121.12 -53.95 0.04 OUTLIER Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.185 179.736 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.458 ' CD ' ' H ' ' A' ' 42' ' ' GLN . 23.1 Cg_exo -64.92 93.2 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.176 1.917 . . . . 0.0 112.046 179.748 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.59 168.05 6.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.107 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.27 100.59 10.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.984 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -95.39 146.43 24.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.979 -179.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 24.1 m -106.53 171.35 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.087 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -90.97 42.96 1.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.792 179.9 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.99 36.18 3.32 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.499 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.55 61.77 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.53 120.63 71.17 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' O ' ' SD ' ' A' ' 57' ' ' MET . 61.5 Cg_endo -73.13 -167.02 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.445 2.097 . . . . 0.0 112.377 -179.668 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.784 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -90.37 146.79 23.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.59 -179.94 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.81 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -166.86 -176.35 3.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.144 0.497 . . . . 0.0 111.999 179.553 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.08 -56.91 12.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.393 -0.822 . . . . 0.0 112.686 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.2 m -47.37 -34.36 6.89 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.105 0.478 . . . . 0.0 110.97 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.674 ' SD ' ' HA ' ' A' ' 53' ' ' LEU . 4.3 mtt -75.35 -41.54 56.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.447 179.141 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -55.98 -38.09 69.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.822 176.859 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.22 -23.66 62.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.428 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -68.15 -7.39 29.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.29 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.746 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.4 63.57 65.64 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.259 -179.742 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.639 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.3 Cg_exo -55.0 -53.13 6.44 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.514 2.143 . . . . 0.0 113.028 -179.08 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.5 Cg_endo -98.51 22.95 0.26 Allowed 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.539 2.16 . . . . 0.0 112.757 -179.156 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.746 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -128.4 -94.89 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.711 -178.852 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.69 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.12 40.14 1.73 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -177.813 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.567 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -70.92 -23.06 62.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.903 0.382 . . . . 0.0 110.86 179.369 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.611 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.4 28.99 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.966 -179.822 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.429 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -134.08 -52.02 0.84 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.194 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.69 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -78.48 15.89 0.92 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -177.175 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.43 -31.72 17.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.115 0.483 . . . . 0.0 110.591 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.024 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.36 10.39 5.31 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.552 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -127.92 -6.17 5.59 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.583 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -126.54 -16.51 5.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.935 0.397 . . . . 0.0 110.565 179.354 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.784 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.72 -16.75 58.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.059 178.964 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.725 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 13.8 t80 -49.34 -53.88 35.48 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.924 -177.543 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.1 Cg_exo -65.73 -6.45 14.0 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.149 1.9 . . . . 0.0 112.494 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.608 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.78 -38.68 8.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.635 -179.274 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.783 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.8 mm -60.0 -40.47 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.883 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.904 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 31.0 mt-30 -47.66 -21.45 0.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.796 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.11 -44.03 17.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.848 178.904 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -66.78 -43.14 84.75 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.302 0.572 . . . . 0.0 110.225 179.187 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.871 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.7 m170 -121.52 143.99 39.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.456 -177.729 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.53 80.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.563 2.175 . . . . 0.0 112.254 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.904 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 61.9 p 43.32 32.72 0.51 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.196 -179.115 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -88.34 6.93 34.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.09 -179.367 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.783 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.59 20.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.882 -179.422 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -54.26 -22.62 22.88 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.834 -179.933 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.0 OUTLIER -165.46 28.76 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.0 111.216 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.866 HG21 HG13 ' A' ' 115' ' ' VAL . 60.8 mt -80.42 -88.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.386 -0.525 . . . . 0.0 110.817 179.019 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.024 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.02 -41.5 59.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.279 -179.943 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.67 -31.13 57.48 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.068 -1.063 . . . . 0.0 111.055 178.497 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.63 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.43 -23.29 32.37 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 178.685 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.628 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.63 -7.53 3.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.631 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.666 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.6 mp -106.66 26.26 10.2 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.7 pt-20 -167.08 1.87 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.33 -178.608 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.948 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -151.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 121.334 0.587 . . . . 0.0 111.697 -179.702 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 0.8 OUTLIER -59.04 -3.56 0.37 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.998 177.949 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 34.3 m-80 79.19 -28.65 0.15 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.524 179.536 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -31.22 60.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.09 0.471 . . . . 0.0 109.877 178.201 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.948 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -75.42 -23.32 56.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.937 177.863 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -75.1 -25.62 58.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.862 177.031 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mp -87.15 -49.38 7.33 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.984 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.49 -46.97 87.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.709 -179.548 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.924 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -53.2 -36.51 61.05 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -178.169 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' HD23 ' A' ' 58' ' ' LEU . 6.9 mt -86.64 -5.5 59.11 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.342 0.592 . . . . 0.0 110.071 179.1 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -110.44 -8.09 14.71 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.001 -175.026 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.476 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.4 OUTLIER -146.25 142.0 17.09 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.061 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.507 ' O ' HG21 ' A' ' 54' ' ' THR . 7.5 Cg_exo -73.2 -0.57 9.34 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 179.437 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -124.43 -19.38 5.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.568 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 4.4 p -63.74 -50.53 68.71 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.233 0.54 . . . . 0.0 109.79 178.169 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.924 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -46.49 -29.24 1.67 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.118 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.59 -63.42 1.23 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.985 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 43.5 m -49.31 -30.21 7.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.958 179.15 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.0 mmtm -80.84 -41.22 23.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.844 178.093 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.866 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -66.43 -62.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.124 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t0 -48.67 -36.13 15.37 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.644 0.259 . . . . 0.0 111.258 178.608 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 113' ' ' SER . 7.4 mt-10 -74.05 -41.14 62.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.818 0.342 . . . . 0.0 110.514 179.114 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.44 -21.77 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.691 178.057 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.871 HG21 ' CE1' ' A' ' 82' ' ' HIS . 59.1 t -66.79 -46.43 85.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.866 177.412 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.16 -26.57 66.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.506 176.652 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 11.2 t -85.32 -32.08 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.579 179.057 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.503 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.79 -35.77 70.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.825 179.004 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -71.97 -28.52 63.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.114 178.33 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.88 -6.32 57.39 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.235 179.234 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.614 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -122.05 8.35 9.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.561 -178.808 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 20.1 mt-30 -75.43 -105.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.611 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.42 26.56 3.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.85 0.357 . . . . 0.0 110.998 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.17 -148.7 0.3 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.055 -179.196 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.04 49.2 1.77 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.074 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.614 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -88.71 19.29 4.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.62 -1.15 41.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.739 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.83 108.59 9.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.905 179.896 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 9.8 mttp -66.64 -27.22 67.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.006 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.38 157.67 35.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 -179.988 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.2 m -95.84 173.05 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.151 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -66.36 157.61 31.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.941 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.46 132.8 42.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.986 -179.973 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -77.84 92.26 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.068 179.897 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 72.8 p -102.53 -12.34 17.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.917 -179.942 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -87.92 -66.93 1.31 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.545 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 5.2 t -100.86 129.96 26.27 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.476 0.179 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -82.22 165.82 71.73 Favored 'Cis proline' 0 C--N 1.349 0.557 0 C-N-CA 123.562 -1.432 . . . . 0.0 112.483 0.228 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 77.7 p -85.83 -172.32 4.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.076 179.899 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.526 -0.23 . . . . 0.0 112.526 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.07 -32.12 64.6 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.564 2.176 . . . . 0.0 112.137 179.873 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.6 mt -98.59 177.09 5.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.962 179.957 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.77 -62.16 0.68 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.514 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -103.52 154.21 19.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.342 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -145.8 47.04 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.004 -179.994 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.7 -3.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.17 -179.872 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.404 ' H ' ' H ' ' A' ' 9' ' ' ALA . . . -159.53 -13.95 0.06 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.995 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.404 ' H ' ' H ' ' A' ' 8' ' ' ALA . . . 59.11 -91.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.205 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 5.1 m 64.91 124.04 0.02 OUTLIER Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.251 179.774 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' A' ' 10' ' ' THR . 94.1 Cg_endo -79.65 170.88 65.87 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.545 -1.44 . . . . 0.0 112.419 -0.036 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.18 -46.24 11.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.001 179.847 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.4 m -81.07 174.72 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.097 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 14' ' ' ARG . 3.6 mtp180 -98.82 84.6 3.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -111.85 21.29 16.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.583 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 35.1 m -92.24 -29.5 0.31 Allowed Pre-proline 0 CA--C 1.54 0.57 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 16' ' ' VAL . 25.4 Cg_exo -63.6 176.89 1.97 Allowed 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.747 1.631 . . . . 0.0 112.12 -179.834 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -75.81 -168.78 0.94 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.969 -179.955 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -63.64 106.04 0.9 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 109.91 22.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.026 179.956 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -77.43 82.67 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.806 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.31 130.26 35.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.161 -179.655 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.43 120.11 15.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.009 179.812 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.26 52.29 1.08 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.569 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.0 p -86.45 -31.66 6.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 179.891 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 -88.87 108.07 19.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.909 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -90.42 144.77 31.32 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.86 23.02 0.58 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.529 2.152 . . . . 0.0 112.645 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -72.9 102.09 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.864 179.766 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -92.66 -79.74 0.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.07 -179.681 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 54.66 49.17 18.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 -179.83 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.28 117.71 19.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.017 -179.737 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.21 72.85 7.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.668 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.71 76.44 5.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.16 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.525 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 1.1 tm0? -83.01 -51.05 0.69 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 54.3 Cg_endo -69.0 -17.89 40.84 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.199 1.933 . . . . 0.0 112.169 179.766 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.95 109.33 10.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -97.62 90.81 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 179.921 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -109.17 -56.92 2.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.987 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.33 168.19 11.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.981 -179.896 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -85.79 154.0 21.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.967 179.987 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -117.96 91.09 38.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.51 126.88 23.78 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.64 2.227 . . . . 0.0 112.302 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.72 90.36 8.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.045 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -101.5 92.84 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.115 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -82.27 105.36 13.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 -179.895 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 6.3 p -109.95 19.31 6.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.114 0.483 . . . . 0.0 110.893 -179.882 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.35 -34.51 76.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.742 179.579 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.91 79.58 1.85 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.322 179.617 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.71 104.12 14.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.807 0.337 . . . . 0.0 111.017 -179.69 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.624 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 2.2 mt-10 -75.34 -49.16 4.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.448 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.624 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 18.4 Cg_endo -58.07 144.99 93.92 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.215 1.944 . . . . 0.0 112.241 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.825 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -83.07 148.11 27.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.95 -179.828 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.904 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -163.62 -171.95 2.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.489 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.73 -36.88 62.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.192 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.95 -46.01 92.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.064 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.825 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.66 -43.22 89.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.056 178.325 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.532 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -57.77 -48.23 80.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.572 178.973 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.37 -3.21 19.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.367 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.466 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 8.4 t -87.23 -6.77 58.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.074 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.613 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.7 53.98 11.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.675 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.613 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 88.5 Cg_endo -103.21 114.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.018 2.479 . . . . 0.0 113.241 -178.53 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 91.4 Cg_endo -101.11 132.11 1.71 Allowed 'Cis proline' 0 N--CA 1.456 -0.706 0 C-N-CA 124.574 -1.011 . . . . 0.0 112.388 -0.205 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.519 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -173.23 -86.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.738 0.304 . . . . 0.0 111.211 179.792 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.504 ' HB3' ' HG2' ' A' ' 69' ' ' MET . 4.4 mm-40 -94.19 8.13 42.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.999 -179.249 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -48.32 66.08 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.648 179.406 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.651 ' HA ' HD21 ' A' ' 70' ' ' LEU . 5.4 ptpt -116.18 40.65 2.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.888 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' A' ' 65' ' ' GLU . 45.4 mt-30 -139.23 -54.54 0.58 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.721 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.614 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -81.08 3.07 24.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.849 -178.889 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.816 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -69.97 -39.33 76.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 0.0 111.085 179.765 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.082 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.34 24.96 3.34 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.236 -0.983 . . . . 0.0 112.87 -179.504 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -138.09 -5.42 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.582 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.28 -20.85 4.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.873 -179.825 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.744 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -74.83 -13.09 60.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.692 -178.748 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.719 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 8.4 t80 -48.32 -56.71 13.06 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.703 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.719 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 24.5 Cg_exo -63.29 -11.7 26.77 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.042 1.828 . . . . 0.0 112.046 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.1 mm? -94.79 -28.35 15.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.462 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.763 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -67.78 -39.64 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.013 -179.608 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.881 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -50.47 -20.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 110.125 178.682 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.75 -40.87 24.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.449 179.668 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.763 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.44 -50.75 28.7 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.184 0.516 . . . . 0.0 110.52 -179.62 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.784 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -111.49 151.61 43.39 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.491 -179.673 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.612 ' HG2' HD23 ' A' ' 85' ' ' LEU . 18.8 Cg_endo -59.53 81.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.387 2.058 . . . . 0.0 111.798 179.555 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.881 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.0 t 42.13 31.0 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.532 -178.776 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.654 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -80.45 2.22 26.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.01 -144.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.971 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.72 -15.62 50.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.69 -179.114 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.833 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.1 tptt -156.46 -22.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.953 HG21 HG13 ' A' ' 115' ' ' VAL . 68.4 mt -49.25 -86.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -177.491 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.082 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.97 -41.83 64.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.276 -178.599 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.27 -31.45 50.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.217 178.463 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.833 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.79 -25.06 30.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.885 0.374 . . . . 0.0 110.323 179.185 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.616 HD12 ' HE3' ' A' ' 104' ' ' MET . 4.1 mm? -59.08 -10.86 2.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.417 178.971 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.816 HD21 HD13 ' A' ' 70' ' ' LEU . 3.8 mp -101.89 25.97 8.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.728 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -169.1 1.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.154 -177.614 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.42 -148.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.41 0.624 . . . . 0.0 111.408 -179.417 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.616 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.2 t70 -54.33 -9.42 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.824 176.081 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.719 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 79.88 -23.1 0.25 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.138 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -32.74 58.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.408 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -69.65 -34.64 74.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.049 177.545 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.668 HD21 HD22 ' A' ' 70' ' ' LEU . 2.3 tm? -65.9 -28.73 69.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.274 178.741 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.15 -49.85 9.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.911 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.509 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 1.5 t-80 -58.79 -48.44 81.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.958 -178.888 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.801 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.9 OUTLIER -52.29 -35.5 50.56 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.157 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 101' ' ' LEU . 17.5 mt -84.8 -8.78 58.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 0.0 110.791 -179.404 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.06 -7.33 16.14 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.615 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.467 ' HB3' ' H ' ' A' ' 110' ' ' SER . 0.5 OUTLIER -143.13 140.15 17.53 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 120.506 -0.477 . . . . 0.0 112.042 -179.169 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.563 ' O ' HG21 ' A' ' 54' ' ' THR . 60.1 Cg_endo -72.18 3.8 3.77 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.645 2.23 . . . . 0.0 111.991 179.07 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -128.72 -19.01 3.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.467 ' H ' ' HB3' ' A' ' 107' ' ' SER . 4.9 p -64.22 -49.86 70.29 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.356 0.598 . . . . 0.0 109.675 177.447 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.904 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.95 -26.78 1.07 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.783 178.05 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -95.94 -65.69 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.78 179.311 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 5.0 m -46.12 -30.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.296 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.786 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 69.4 mmtt -80.44 -42.44 22.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.697 177.819 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.953 HG13 HG21 ' A' ' 89' ' ' ILE . 2.2 t -66.06 -60.37 2.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.874 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.404 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t70 -48.0 -38.9 18.14 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.31 178.679 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 113' ' ' SER . 1.9 mt-10 -76.87 -33.27 57.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.271 179.466 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.751 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.55 -26.79 66.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.882 177.958 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.784 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.0 t -61.52 -51.14 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.05 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.58 32.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.779 177.333 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 14.3 t -85.52 -31.35 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.945 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.701 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.53 -41.31 63.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.026 179.363 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.43 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 2.3 mm100 -61.69 -37.96 86.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 178.822 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -65.82 -79.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.352 177.072 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -31.49 -37.53 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.715 0.634 . . . . 0.0 112.223 -178.61 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 22.0 mt-30 -62.44 -83.38 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 179.256 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.56 31.35 2.3 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.811 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.654 ' HG3' ' N ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -96.22 -160.33 0.79 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.243 0.544 . . . . 0.0 111.18 179.034 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.93 31.55 0.78 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.325 176.594 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.654 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -69.24 5.2 1.33 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.876 -177.613 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.24 13.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.489 -179.432 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -68.46 -20.1 64.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.1 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.37 7.06 15.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.021 -179.776 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -94.45 -39.23 10.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.136 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 135' ' ' VAL . 12.3 m -84.53 -5.09 9.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.207 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -85.73 123.97 31.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.916 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 48.1 p -86.59 115.4 24.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.021 -179.889 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.82 76.56 8.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.95 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 12.3 t -97.47 20.84 11.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.789 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -78.48 111.57 3.28 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.566 179.975 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 3.0 t -96.28 129.24 34.09 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.511 0.196 . . . . 0.0 110.984 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -55.93 118.7 5.52 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.525 2.15 . . . . 0.0 112.317 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 3.6 p -87.72 50.08 1.93 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.1 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.178 179.938 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.143 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.96 168.58 22.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.517 2.145 . . . . 0.0 112.404 -179.851 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.69 138.65 35.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.925 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.15 4.82 45.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.507 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.07 -67.67 0.79 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 110.924 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.47 -166.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.163 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.58 -80.08 0.44 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.171 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -151.55 118.08 5.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.47 27.39 1.72 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.062 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.686 ' N ' ' HA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -78.99 -50.6 1.39 Allowed Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.585 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.686 ' HA ' ' N ' ' A' ' 10' ' ' THR . 68.8 Cg_endo -91.5 -5.78 46.07 Favored 'Cis proline' 0 C--N 1.355 0.917 0 C-N-CA 124.603 -0.999 . . . . 0.0 112.648 0.479 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.564 ' N ' ' HB ' ' A' ' 10' ' ' THR . . . -70.22 94.93 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.034 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.9 t -92.31 92.79 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.056 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -96.36 -60.46 1.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.894 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.652 HG22 ' HD3' ' A' ' 63' ' ' PRO . 5.9 p -103.49 92.34 4.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.837 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.575 HG22 ' H ' ' A' ' 18' ' ' GLN . 4.2 p -102.38 126.42 33.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.972 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 28.1 Cg_exo -62.25 -26.2 77.28 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.625 2.217 . . . . 0.0 112.222 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.575 ' H ' HG22 ' A' ' 16' ' ' VAL . 15.8 mm100 -82.91 163.42 21.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.93 -179.797 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -78.61 172.78 13.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.908 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 65.2 0.94 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.81 179.932 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -74.06 -18.05 60.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.57 -49.91 9.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.092 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.17 114.73 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.095 -179.844 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.633 ' HA3' ' HG2' ' A' ' 28' ' ' PRO . . . -104.08 91.01 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.388 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.656 ' HA ' ' HB2' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -107.32 4.86 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.808 0.337 . . . . 0.0 111.134 -179.665 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -98.51 -72.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.083 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.545 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 10.6 m-80 -90.82 -50.61 0.33 Allowed Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.536 -179.47 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.633 ' HG2' ' HA3' ' A' ' 24' ' ' GLY . 47.5 Cg_exo -57.24 -31.47 90.82 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.192 1.928 . . . . 0.0 112.499 -179.549 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.656 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -78.34 -21.98 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.125 -179.664 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -99.41 178.12 4.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.866 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 -98.24 40.02 1.21 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.813 179.88 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.96 4.36 26.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.973 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 97.47 8.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.857 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.13 58.09 4.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.498 ' HB3' ' HD3' ' A' ' 36' ' ' PRO . 18.6 tt0 -81.23 -51.92 0.86 Allowed Pre-proline 0 CA--C 1.533 0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.389 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.766 ' HB2' HG22 ' A' ' 38' ' ' VAL . 93.7 Cg_endo -78.62 137.95 14.86 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.171 1.914 . . . . 0.0 112.32 -179.905 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -90.69 39.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.766 HG22 ' HB2' ' A' ' 36' ' ' PRO . 1.9 m -98.55 67.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.071 -179.959 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.37 89.67 7.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.919 -179.947 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 37.7 mtm -83.72 1.3 43.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 179.918 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 55.38 63.98 1.92 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.99 -179.762 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -136.34 92.22 15.78 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 -179.887 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.25 -168.89 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.591 2.194 . . . . 0.0 112.275 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.12 156.58 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.068 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.526 HG23 ' H ' ' A' ' 46' ' ' HIS . 0.0 OUTLIER -97.82 -79.2 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.935 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.526 ' H ' HG23 ' A' ' 45' ' ' VAL . 36.8 m80 -110.26 94.17 4.87 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.975 0.417 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.466 ' O ' ' HG3' ' A' ' 50' ' ' GLN . 9.8 p -88.88 31.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.202 0.525 . . . . 0.0 110.944 -179.684 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -68.01 -18.14 64.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.0 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.77 67.24 0.58 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.871 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 47' ' ' VAL . 89.6 mt-30 -93.04 100.82 13.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.739 0.304 . . . . 0.0 110.88 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 1.7 mm-40 -85.89 108.37 16.59 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.913 -179.916 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 6.3 Cg_exo -78.85 -177.07 3.63 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.872 2.381 . . . . 0.0 112.058 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.735 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -79.21 153.65 29.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.736 179.347 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.886 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.11 -176.44 2.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.294 179.099 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.972 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.23 -25.06 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 111.269 -179.488 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.449 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 40.6 m -74.23 -49.13 24.65 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.741 179.562 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.735 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.11 -39.45 78.69 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.376 0.608 . . . . 0.0 109.997 178.776 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.972 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.3 mt -64.1 -45.04 90.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.418 179.102 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.79 -7.85 18.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.844 179.066 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.465 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 23.4 t -84.05 -7.3 59.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.616 179.317 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.589 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.18 55.47 16.96 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.319 179.819 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.589 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 62.7 Cg_endo -101.59 122.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.184 2.589 . . . . 0.0 112.986 -178.435 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.652 ' HD3' HG22 ' A' ' 15' ' ' THR . 88.8 Cg_endo -100.1 31.33 10.8 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 124.463 -1.057 . . . . 0.0 112.095 -0.606 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.529 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 11.5 tt0 -55.61 -89.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.586 -178.428 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.677 ' HB3' ' HB3' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -107.11 28.14 8.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.004 -179.29 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -44.0 69.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.051 0.453 . . . . 0.0 110.123 179.147 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.456 ' C ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -107.85 36.72 2.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.473 178.471 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.677 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.3 tp-100 -127.6 -52.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.666 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 14.4 mtm -76.03 -6.17 49.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.659 -179.378 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.82 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -63.2 -32.45 73.85 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.172 -179.421 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 1.036 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -148.74 27.48 1.31 Allowed Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.822 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 3.3 mt-10 -142.29 0.39 1.33 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.891 0.377 . . . . 0.0 111.173 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -136.12 -20.84 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.169 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.647 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -73.48 -22.7 60.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.353 178.283 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.538 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -39.82 -56.04 3.34 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.355 -177.906 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 11.6 Cg_exo -73.1 -15.74 25.69 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.326 2.017 . . . . 0.0 112.784 -179.255 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.68 HD12 ' HB2' ' A' ' 53' ' ' LEU . 37.1 mt -91.23 -32.01 15.93 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.624 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 74' ' ' LEU . 2.5 mm -65.19 -37.13 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.089 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.768 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.0 mt-30 -48.92 -16.16 0.12 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.495 177.14 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.429 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -84.27 -44.58 13.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.675 178.186 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.427 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 1.2 mtm -67.67 -27.81 67.16 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.563 0.697 . . . . 0.0 110.18 178.955 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.616 ' CD2' HD11 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -114.29 164.2 16.97 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.739 -177.257 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.498 ' HD2' ' CG ' ' A' ' 82' ' ' HIS . 74.0 Cg_endo -77.11 47.68 2.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.134 1.889 . . . . 0.0 111.368 177.021 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.768 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 66.45 51.05 1.2 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.796 -178.487 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HB3' ' CD2' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -118.94 0.81 11.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.719 179.789 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.556 ' CB ' ' HB ' ' A' ' 78' ' ' ILE . . . -73.46 58.63 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.179 179.455 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -98.24 -0.7 58.3 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.885 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.5 ttpt -156.74 -15.79 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.023 -0.588 . . . . 0.0 111.908 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.958 HG21 HG13 ' A' ' 115' ' ' VAL . 48.5 mt -51.18 -84.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -176.812 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 90' ' ' THR . . . . . 1.036 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -51.46 -38.37 53.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.02 -177.851 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.95 -29.87 68.77 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.99 -1.1 . . . . 0.0 110.367 176.262 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.885 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.4 ttm -75.56 -37.75 59.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.042 176.996 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.577 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.6 mm? -55.61 -8.34 0.37 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.48 -178.896 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.82 HD11 HD13 ' A' ' 70' ' ' LEU . 4.9 mp -106.26 27.94 8.2 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.688 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.407 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -171.98 3.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.462 -178.252 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.934 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.22 -151.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.318 0.58 . . . . 0.0 111.496 -179.86 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.509 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.8 t0 -59.53 -3.54 0.48 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.237 178.253 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.594 ' H ' HG12 ' A' ' 96' ' ' ILE . 27.4 m120 77.82 -27.23 0.17 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.425 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -77.75 -23.35 49.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 177.785 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.934 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.92 -25.87 29.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.676 177.512 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -74.99 -24.75 58.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.393 0.615 . . . . 0.0 109.385 176.134 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -86.73 -48.6 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.074 -0.967 . . . . 0.0 111.158 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.446 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.04 -37.28 83.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.194 -178.695 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.825 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -57.56 -36.82 72.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.136 -179.85 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.714 HD23 HD13 ' A' ' 58' ' ' LEU . 6.9 mt -87.11 -9.77 54.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.211 0.529 . . . . 0.0 110.047 178.445 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 62.8 mm-40 -108.44 -1.98 19.4 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.28 -176.144 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.845 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -150.32 135.95 10.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.764 -179.462 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.528 ' O ' HG21 ' A' ' 54' ' ' THR . 72.5 Cg_endo -74.04 3.98 4.63 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.566 2.177 . . . . 0.0 112.04 179.025 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 113' ' ' SER . 7.7 mt-10 -128.0 -11.41 5.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.607 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.845 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.83 -44.68 22.48 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.606 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.886 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.28 -40.82 17.67 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.95 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -81.16 -64.39 1.2 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.28 179.38 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.01 -51.13 25.24 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 -178.702 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.814 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 30.9 mmtt -61.01 -30.18 70.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.845 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.958 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -72.83 -55.0 14.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.981 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.62 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 0.5 OUTLIER -56.9 -28.65 62.2 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.227 0.537 . . . . 0.0 109.927 177.314 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -80.02 -33.93 38.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.383 177.223 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.736 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.67 -17.87 64.17 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.514 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.62 ' HB ' ' O ' ' A' ' 116' ' ' ASP . 37.1 t -66.77 -52.79 41.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.412 175.864 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.06 -27.49 61.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.968 177.389 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 15.2 t -85.94 -31.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.691 179.123 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -74.14 -29.35 61.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.348 -179.733 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -83.2 -23.59 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.786 177.28 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -86.94 -6.14 58.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.054 179.32 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -115.61 -36.13 4.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.82 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.82 -81.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 177.721 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.29 54.93 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 174.165 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 128.55 36.29 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.043 -175.113 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -87.18 -1.14 57.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.333 177.347 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.81 -7.28 49.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.72 -8.73 57.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.6 130.66 43.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.92 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 29.5 mmtt -69.18 -18.47 63.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.841 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.07 112.41 23.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.995 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 4.6 m -88.67 48.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -90.14 16.41 8.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.869 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.6 -65.69 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -86.44 -44.45 12.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.15 -179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.92 93.54 8.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.904 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -96.74 158.79 21.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.541 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.631 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 12.0 t -97.7 -51.49 0.22 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.772 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.631 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 47.4 Cg_exo -56.45 -52.41 7.13 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.15 1.9 . . . . 0.0 112.323 -179.866 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 67.7 p -105.61 126.04 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.014 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.008 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.679 HD12 ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.838 0.351 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.689 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -173.98 -163.76 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.514 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.666 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.29 -43.8 88.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.506 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 m -56.56 -45.39 81.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.844 0.354 . . . . 0.0 110.487 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.43 -40.43 94.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.666 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -60.98 -45.38 95.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -9.1 52.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.08 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.0 t -82.41 -8.73 59.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.169 179.72 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.053 0.454 . . . . 0.0 110.772 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.577 ' CA ' HD21 ' A' ' 70' ' ' LEU . 4.7 mmtt -124.79 35.17 4.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.577 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -130.42 -61.97 0.94 Allowed 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.5 ' HA ' ' HB2' ' A' ' 73' ' ' ARG . 35.9 mtm -58.82 -9.38 1.76 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.712 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -70.12 -28.31 65.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.961 0.41 . . . . 0.0 110.81 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.046 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -146.52 9.92 1.45 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.442 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.28 -9.62 6.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.538 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.16 -12.73 5.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.909 0.385 . . . . 0.0 110.531 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.679 ' HG ' HD12 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.59 -17.1 58.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.928 -179.313 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.704 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.7 t80 -47.12 -54.57 19.93 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 22.1 Cg_exo -65.37 -9.25 21.48 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.134 1.889 . . . . 0.0 112.249 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.3 mm? -96.3 -39.06 9.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.794 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.675 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.0 mm -60.34 -41.61 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.859 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.674 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.4 mt-30 -48.53 -20.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.627 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.72 -43.67 16.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.856 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.466 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -67.78 -40.85 83.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.5 179.604 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.846 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.9 m170 -123.18 144.1 42.65 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.55 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -55.75 81.57 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.478 2.119 . . . . 0.0 111.715 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.674 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 9.4 t 41.42 30.3 0.13 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.276 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.56 0.4 34.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.675 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.67 -138.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.621 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.88 -8.56 49.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.856 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.573 ' HE2' ' SD ' ' A' ' 92' ' ' MET . 1.2 tptt -161.3 -25.6 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.738 -0.231 . . . . 0.0 111.501 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.81 HG21 HG13 ' A' ' 115' ' ' VAL . 61.0 mt -49.2 -80.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.046 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.63 -38.51 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.684 -0.235 . . . . 0.0 110.937 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.79 -28.7 57.55 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.573 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.39 -34.34 54.9 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.199 0.523 . . . . 0.0 109.827 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.949 ' HB3' ' HE3' ' A' ' 104' ' ' MET . 4.5 mm? -58.76 -7.97 1.17 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.691 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.694 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.4 mp -107.84 27.83 8.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.404 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.9 pt-20 -171.59 3.24 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.521 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.964 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.332 0.587 . . . . 0.0 111.85 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.42 -2.46 0.32 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.361 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 9.6 m-20 78.27 -30.12 0.16 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.42 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.87 -31.88 65.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.074 0.464 . . . . 0.0 109.83 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.964 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.9 OUTLIER -76.37 -23.3 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.775 177.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.629 ' HB2' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -75.27 -23.75 57.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.049 177.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.524 HD12 HD23 ' A' ' 101' ' ' LEU . 3.7 mp -91.07 -45.67 8.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.3 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.408 ' HD2' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.32 -39.6 92.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.056 -179.049 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.949 ' HE3' ' HB3' ' A' ' 93' ' ' LEU . 0.1 OUTLIER -59.98 -33.13 71.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.491 -179.56 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.712 HD21 HD13 ' A' ' 70' ' ' LEU . 17.3 mt -85.37 -12.35 52.37 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.742 0.306 . . . . 0.0 110.946 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.408 ' HG2' ' HD2' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -105.83 -8.62 17.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.783 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -142.89 132.54 11.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.87 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 13.8 Cg_exo -69.88 1.62 4.35 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.893 2.395 . . . . 0.0 111.913 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -120.37 -26.56 5.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.272 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.93 -45.24 90.13 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.689 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -57.19 -26.28 60.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.062 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -88.28 -46.58 9.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.256 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 t -69.3 -33.53 73.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.874 0.369 . . . . 0.0 110.713 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.681 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 6.8 mmtt -78.85 -27.81 44.2 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.185 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.81 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -72.39 -55.88 11.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.298 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.467 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 20.2 t0 -52.91 -39.01 62.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 177.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -39.66 75.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.423 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.81 -22.07 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.043 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.846 HG21 ' CE1' ' A' ' 82' ' ' HIS . 56.1 t -65.3 -44.77 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.938 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.14 -25.93 65.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.505 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.2 t -86.92 -31.39 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.857 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -71.98 -40.53 68.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.992 179.178 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.42 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 81.1 mm-40 -68.48 -32.01 71.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.159 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.923 179.065 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.71 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.752 0.31 . . . . 0.0 110.67 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.731 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.58 -167.44 0.78 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.433 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 1.03 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.57 -43.97 65.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.852 -178.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -57.72 -51.23 70.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.874 0.369 . . . . 0.0 110.747 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.514 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.19 -38.59 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.248 179.166 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.03 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.0 mt -63.96 -42.89 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.064 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.18 -15.59 60.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.058 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.6 m -73.86 -6.98 50.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.884 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.039 -179.966 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.918 0.39 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.576 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -129.75 28.65 5.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.841 179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.51 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.37 -54.98 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.965 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.52 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -75.52 18.1 0.25 Allowed 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -177.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.729 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.42 -32.58 17.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.239 0.542 . . . . 0.0 110.445 179.619 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.125 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.15 11.6 4.74 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.037 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.471 ' HG2' ' HG3' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -129.26 -8.54 4.75 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.145 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -127.34 -14.17 5.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.774 0.321 . . . . 0.0 110.969 179.852 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.631 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.31 -10.99 59.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.708 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 11.5 t80 -49.01 -55.41 20.78 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.68 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.6 Cg_exo -62.34 -9.73 16.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.087 1.858 . . . . 0.0 112.157 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.71 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.5 mm? -98.81 -28.21 13.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.579 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.75 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.8 mm -70.6 -40.47 77.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.732 0.301 . . . . 0.0 111.244 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.778 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.7 mt-30 -52.62 -19.3 2.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.351 0.596 . . . . 0.0 110.103 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.26 -38.88 30.04 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.959 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.75 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.2 -48.63 33.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.24 0.543 . . . . 0.0 110.167 179.413 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.848 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.5 m-70 -111.97 146.18 34.26 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.467 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.587 ' HD2' HD12 ' A' ' 85' ' ' LEU . 36.6 Cg_exo -57.18 78.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.544 2.163 . . . . 0.0 112.014 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.778 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 48.17 37.17 7.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.062 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.848 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.3 OUTLIER -92.48 4.99 52.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -179.351 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.635 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.88 -138.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.948 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.85 -10.14 53.38 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.793 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.647 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.1 tptt -159.96 -23.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.694 -0.253 . . . . 0.0 111.536 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.844 HG21 HG13 ' A' ' 115' ' ' VAL . 69.2 mt -49.68 -81.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.125 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -55.95 -37.72 69.39 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.636 0.255 . . . . 0.0 110.672 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.63 -28.45 59.93 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.218 -0.991 . . . . 0.0 110.648 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.8 ttp -76.91 -33.99 57.74 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.352 0.596 . . . . 0.0 109.718 177.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.71 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -60.23 -4.61 0.85 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.829 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.651 HD13 ' HA3' ' A' ' 71' ' ' GLY . 3.4 mp -110.04 25.88 11.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 176.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -168.04 1.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.358 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.92 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.21 -153.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.439 0.638 . . . . 0.0 111.955 -179.531 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -59.82 -2.62 0.41 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.302 178.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.591 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.49 -36.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.163 -179.466 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 3.0 m -65.28 -27.35 68.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.847 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.92 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -82.99 -25.62 32.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.587 177.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.678 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 2.3 tp -75.14 -25.33 58.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.701 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.75 -48.02 7.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.323 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.461 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -65.27 -37.01 85.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.429 -178.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.71 ' HE1' ' HB3' ' A' ' 93' ' ' LEU . 8.2 ptm -60.09 -38.17 82.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.797 0.332 . . . . 0.0 111.083 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.825 HD23 HD13 ' A' ' 58' ' ' LEU . 40.2 mt -81.64 -11.43 59.1 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.953 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.48 -9.11 14.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.857 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.836 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -140.77 126.95 11.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.661 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 17.1 Cg_exo -68.07 6.72 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.876 2.384 . . . . 0.0 112.314 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 107' ' ' SER . 2.1 tt0 -127.8 -26.43 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.1 -46.78 85.72 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -49.99 -23.71 2.18 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.779 178.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 112' ' ' ARG . 15.1 mtp180 -92.96 -62.96 1.28 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.2 t -50.05 -29.54 9.03 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.126 0.489 . . . . 0.0 109.791 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.667 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -81.0 -42.98 20.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.666 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.844 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -63.97 -58.15 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -50.98 -42.72 60.36 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.734 0.302 . . . . 0.0 110.868 178.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 113' ' ' SER . 4.4 mt-10 -70.31 -32.46 70.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.327 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.01 -24.74 64.25 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.113 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.721 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -63.38 -46.11 96.27 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 CA-C-O 121.291 0.567 . . . . 0.0 109.664 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.44 -26.27 63.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.742 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 7.9 t -86.98 -32.63 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.741 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.61 -38.29 77.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.93 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.452 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 14.6 mm100 -74.16 -27.0 60.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.962 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.268 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.073 178.876 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.764 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.613 0.244 . . . . 0.0 110.535 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.889 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -170.21 -159.37 0.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.751 179.501 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -60.69 -37.31 81.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.313 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.3 m -59.8 -46.46 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.349 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.92 -40.65 94.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.191 178.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.626 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.31 -47.19 84.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.561 179.214 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.94 -12.68 61.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.217 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' A' ' 57' ' ' MET . 46.3 t -76.39 -7.36 54.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.185 179.936 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 120.739 0.304 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.54 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.8 mtpt -124.83 18.16 8.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.358 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.75 -43.57 3.13 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.396 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.406 ' HA ' ' HB2' ' A' ' 73' ' ' ARG . 30.4 mtm -77.22 -9.63 58.91 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -39.61 80.49 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.061 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -144.65 28.71 1.89 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.817 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -138.47 -9.32 1.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.583 0.23 . . . . 0.0 111.308 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.06 -14.84 5.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.783 0.325 . . . . 0.0 111.007 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.719 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.01 -25.19 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.855 -179.614 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.483 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.0 t80 -42.75 -55.69 6.94 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.169 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 19.3 Cg_endo -59.7 -18.23 46.97 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.976 1.784 . . . . 0.0 112.386 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 53' ' ' LEU . 84.8 mt -99.09 -22.15 15.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.991 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.626 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.9 mm -65.46 -37.87 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.895 0.379 . . . . 0.0 110.431 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.4 mt-30 -53.93 -18.11 3.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.78 -34.57 30.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.08 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.483 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -79.35 -40.78 29.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.067 -178.326 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.735 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.4 m-70 -118.12 159.68 42.17 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.234 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.69 ' HG2' HD23 ' A' ' 85' ' ' LEU . 37.8 Cg_endo -64.71 75.17 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.31 2.007 . . . . 0.0 111.796 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 43.8 p 45.73 36.09 2.54 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.982 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.69 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -87.23 1.84 51.92 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.045 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.658 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -65.72 -143.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.095 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.31 -11.66 60.39 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.301 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.888 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.1 ttpt -160.47 -21.96 0.06 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.812 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -49.03 -80.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.061 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.6 -39.22 67.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.575 0.226 . . . . 0.0 110.768 -179.37 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.66 -27.54 64.04 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.888 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.8 ttm -76.46 -36.42 57.92 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.516 0.674 . . . . 0.0 109.561 177.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.661 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -57.71 -6.83 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.432 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.14 27.39 9.33 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.43 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.6 pt-20 -170.84 2.57 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.091 -0.958 . . . . 0.0 111.357 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.34 -150.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.456 0.646 . . . . 0.0 111.77 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.563 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 8.1 t0 -59.09 -3.97 0.44 Allowed 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.043 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.585 ' H ' HG12 ' A' ' 96' ' ' ILE . 8.5 m120 78.79 -26.48 0.17 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.483 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.39 -32.12 60.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.103 0.477 . . . . 0.0 109.865 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.2 mt-10 -74.79 -24.85 58.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.837 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.642 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.7 tp -75.02 -24.66 58.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.958 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.9 mp -90.47 -47.03 7.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.122 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -37.12 85.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.352 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.681 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 6.0 ptm -60.07 -39.07 84.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.742 0.306 . . . . 0.0 110.793 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.588 HD21 ' HB3' ' A' ' 70' ' ' LEU . 59.8 mt -78.33 -13.13 59.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.541 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -109.41 -5.13 15.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.037 -177.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.837 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.7 t -147.31 139.69 14.21 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.228 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.659 ' O ' HG21 ' A' ' 54' ' ' THR . 85.8 Cg_endo -80.05 2.92 8.05 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.981 2.454 . . . . 0.0 112.009 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -122.87 -18.96 6.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.306 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.837 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -72.24 -50.62 25.96 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.889 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.1 tt -50.09 -34.19 21.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.112 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -85.69 -60.04 2.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.228 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.5 m -53.63 -35.86 61.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.866 0.365 . . . . 0.0 111.027 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.647 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.2 mmtt -78.73 -28.59 44.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.557 179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.812 HG13 HG21 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -71.07 -50.63 40.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.388 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.415 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.3 -38.82 81.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.432 177.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.1 -33.32 67.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.595 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.807 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -65.43 -30.11 70.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.656 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.735 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -56.61 -53.38 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.699 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.33 -25.68 16.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.348 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.81 -32.55 6.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.422 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.831 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.28 -39.36 74.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.086 179.077 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.492 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -73.13 -26.91 61.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.659 178.049 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.504 179.491 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.782 ' HB2' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.727 0.299 . . . . 0.0 110.823 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.864 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.14 -176.18 1.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.042 178.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.997 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.48 -43.7 45.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.839 -179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -60.36 -48.14 83.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.026 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.613 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.22 -42.06 85.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.294 0.569 . . . . 0.0 110.472 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.997 HD12 ' HA ' ' A' ' 55' ' ' ALA . 9.5 mt -62.38 -45.17 94.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.19 -15.22 44.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.966 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 t -76.08 -6.32 50.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.104 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.934 0.397 . . . . 0.0 110.609 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.645 ' HA ' HD11 ' A' ' 70' ' ' LEU . 9.4 pttt -131.43 26.89 4.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.895 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.458 ' N ' HD21 ' A' ' 70' ' ' LEU . 3.9 mt-30 -131.02 -56.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.426 ' HB2' ' CB ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -77.98 18.35 0.5 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.645 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.1 -32.76 17.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.31 0.576 . . . . 0.0 110.138 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.072 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -131.33 12.6 5.48 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.739 178.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -128.66 -3.42 5.34 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.99 -19.79 4.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.83 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.683 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.29 -22.17 52.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.107 -178.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.648 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.8 t80 -44.55 -55.17 10.78 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.102 -177.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 31.5 Cg_exo -60.4 -15.71 37.28 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.166 1.911 . . . . 0.0 112.711 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.782 HD23 ' HB2' ' A' ' 53' ' ' LEU . 0.1 OUTLIER -98.65 -28.41 13.55 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.341 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.8 mm -61.66 -40.52 86.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.577 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.863 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 19.0 mt-30 -52.31 -17.43 1.15 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.914 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.22 -35.65 23.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.079 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.9 -37.62 58.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.925 -179.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.763 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.8 m-70 -121.22 162.64 34.62 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.502 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -67.46 71.67 0.64 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.298 1.998 . . . . 0.0 111.86 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.863 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.4 p 49.11 32.35 4.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.119 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 27.4 mt -84.71 5.91 26.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.22 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.53 -141.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.898 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.31 -10.67 34.49 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.456 -0.878 . . . . 0.0 111.608 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.857 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.1 OUTLIER -156.3 -25.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 179.791 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.849 HG21 HG13 ' A' ' 115' ' ' VAL . 56.6 mt -49.26 -85.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-O 120.629 0.252 . . . . 0.0 111.558 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.072 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.98 -40.0 66.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.0 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.59 -30.02 58.55 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.168 -1.015 . . . . 0.0 111.029 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.857 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.77 -25.62 32.61 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.77 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.3 mm? -60.77 -8.08 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.677 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.561 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.9 mm? -105.79 25.84 10.35 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.568 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 3.9 pt-20 -167.3 1.58 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.547 -178.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.899 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.0 -152.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.448 0.642 . . . . 0.0 111.963 -179.137 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.5 t70 -59.08 -2.95 0.3 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.272 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.7 m-80 78.14 -28.78 0.16 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.28 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.59 -31.03 64.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.132 0.491 . . . . 0.0 109.839 177.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.899 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.8 OUTLIER -78.17 -22.29 48.9 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.633 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.4 tp -75.14 -24.74 58.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.782 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.403 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.6 mp -91.15 -47.3 7.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.221 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -37.18 86.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.59 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.804 ' HB2' HD22 ' A' ' 111' ' ' LEU . 8.3 ptm -59.53 -38.74 81.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.572 0.225 . . . . 0.0 111.033 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 58' ' ' LEU . 4.0 mt -86.62 -7.71 58.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.11 0.481 . . . . 0.0 110.093 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 68.7 mm-40 -108.99 -5.8 15.92 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.771 -177.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.721 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.3 t -146.05 130.95 8.98 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 111.447 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.472 ' O ' HG21 ' A' ' 54' ' ' THR . 57.0 Cg_endo -70.68 8.6 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.552 2.168 . . . . 0.0 112.076 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.67 -27.51 2.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.308 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.721 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -63.95 -44.57 92.4 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.054 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.15 -42.23 13.63 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 175.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.437 ' HG2' ' N ' ' A' ' 113' ' ' SER . 2.3 ttt180 -79.68 -64.91 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.522 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.437 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 33.3 t -48.65 -52.63 22.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.788 0.328 . . . . 0.0 111.328 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 10.5 mmtm -60.21 -30.96 69.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.05 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.849 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.19 -53.76 20.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -36.91 62.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.031 0.443 . . . . 0.0 110.491 177.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.81 -33.96 60.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.985 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.12 -24.37 65.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.043 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.763 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -65.49 -49.2 79.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.68 176.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.83 -27.49 60.2 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.6 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 6.5 t -84.43 -30.28 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.691 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.16 -37.99 61.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.157 179.122 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -75.28 -20.25 59.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.028 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.636 -179.744 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.848 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.935 0.398 . . . . 0.0 111.269 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.797 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.46 -158.82 0.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.279 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.752 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -60.62 -40.64 92.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.447 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.3 m -58.27 -46.15 86.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.398 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.848 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.45 -43.33 93.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.12 178.558 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.752 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.93 -48.74 75.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.487 178.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.29 -9.69 49.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.665 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.7 m -84.73 -8.38 58.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.217 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.553 -179.814 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.627 ' C ' HD21 ' A' ' 70' ' ' LEU . 35.9 mtmt -131.94 29.21 4.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.216 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 4.0 mt-30 -127.37 -48.1 1.44 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.56 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -81.03 13.76 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.179 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.798 HD22 ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -81.55 -40.35 23.24 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 120.906 0.384 . . . . 0.0 110.121 179.328 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.052 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.8 36.13 2.41 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.84 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 1.4 pt-20 -150.85 -11.85 0.23 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.434 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.92 -15.29 5.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 110.687 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.708 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.92 -12.43 59.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.31 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.476 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 9.1 t80 -48.19 -54.91 21.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.818 -177.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.7 Cg_endo -65.03 -8.08 17.2 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.114 1.876 . . . . 0.0 112.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.589 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.6 mm? -98.54 -28.19 13.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.267 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.779 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.7 mm -69.13 -40.38 80.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.322 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.937 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.9 mt-30 -51.19 -18.3 0.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.281 0.562 . . . . 0.0 110.355 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.35 -39.98 22.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.211 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.779 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.74 -44.35 61.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.091 0.472 . . . . 0.0 110.742 -179.596 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.738 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.7 m-70 -115.51 155.76 46.84 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.642 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -62.92 76.18 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.508 2.139 . . . . 0.0 111.736 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.937 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.5 p 46.84 33.7 2.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.133 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.701 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 17.9 mt -87.18 6.41 33.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.211 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.672 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.6 -137.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.961 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.1 -15.86 25.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.769 -178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.886 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.0 ttpt -156.62 -21.6 0.1 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.845 HG21 HG13 ' A' ' 115' ' ' VAL . 62.0 mt -49.54 -81.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.052 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.26 -39.3 66.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.455 0.169 . . . . 0.0 110.795 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.07 -28.03 63.3 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.093 -1.051 . . . . 0.0 110.573 176.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.886 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.7 ttm -76.32 -36.87 58.07 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.521 0.677 . . . . 0.0 109.793 177.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -56.98 -6.32 0.34 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.561 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 70' ' ' LEU . 2.3 mm? -108.75 27.7 9.17 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.419 ' H ' ' H ' ' A' ' 96' ' ' ILE . 6.5 pt-20 -170.1 1.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.195 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.958 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.16 -153.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 121.4 0.619 . . . . 0.0 111.616 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 96' ' ' ILE . 7.6 t0 -59.34 -3.14 0.37 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.139 178.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.58 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.9 -35.14 0.17 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.264 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -67.32 -25.77 66.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.833 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.958 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.56 -24.67 31.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.858 177.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -74.95 -27.19 60.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.54 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.7 mp -86.69 -46.83 9.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.36 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -37.93 85.06 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.201 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.771 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.86 -36.09 74.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.157 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 16.3 mt -86.92 -9.92 54.53 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.136 0.493 . . . . 0.0 110.1 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -107.5 -6.44 17.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.258 -176.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.856 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -148.71 130.33 7.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.636 0.255 . . . . 0.0 111.518 -179.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.482 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.57 -0.53 6.08 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.926 2.417 . . . . 0.0 112.465 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -123.69 -13.66 7.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.535 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.856 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -71.94 -46.04 58.96 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.016 0.436 . . . . 0.0 110.202 178.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.797 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.4 tt -56.17 -29.23 60.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.12 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -88.2 -51.64 5.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.266 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 m -64.02 -35.1 79.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.958 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 27.0 mmtt -78.98 -29.5 43.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.58 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.81 -51.44 40.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.158 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.65 -37.76 73.9 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.378 178.695 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -37.58 70.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.696 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.87 -26.97 69.03 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.962 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.738 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.5 t -62.13 -47.69 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.305 0.574 . . . . 0.0 109.807 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.73 -24.27 61.25 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.857 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.9 t -87.15 -35.42 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.421 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.78 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -66.31 -38.68 88.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 4.6 mm-40 -71.99 -29.11 63.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.406 176.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.232 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.558 179.043 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.749 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.659 0.266 . . . . 0.0 110.893 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.791 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.79 -161.86 0.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.666 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -59.59 -36.92 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.382 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 2.0 m -60.73 -45.7 93.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.405 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.81 -40.96 94.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.262 0.553 . . . . 0.0 110.113 178.371 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.629 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.04 -47.88 81.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.721 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -8.88 50.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 t -81.75 -9.51 59.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.007 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.163 179.791 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.105 0 CA-C-O 120.932 0.396 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.569 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -128.49 34.85 4.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.49 ' N ' HD21 ' A' ' 70' ' ' LEU . 38.2 tt0 -133.29 -53.86 0.9 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.876 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.511 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.2 ptt? -80.63 22.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.599 HD23 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.16 -40.9 12.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.118 0.485 . . . . 0.0 110.196 179.384 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.974 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -125.64 13.79 7.27 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -130.1 -2.4 4.56 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.511 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 20.4 tpp180 -127.11 -22.9 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.081 0.467 . . . . 0.0 111.107 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.99 -17.82 60.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.008 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 11.2 t80 -46.02 -54.88 14.95 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 27.6 Cg_endo -62.17 -15.27 43.15 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.121 1.88 . . . . 0.0 112.506 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.749 HD12 ' HB2' ' A' ' 53' ' ' LEU . 54.2 mt -98.74 -23.38 15.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.898 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.2 mm -66.37 -41.28 88.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.371 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.6 mt-30 -53.25 -18.37 2.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.58 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.56 -36.09 29.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.84 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.421 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.84 -51.29 14.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.68 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.749 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.2 m-70 -105.16 160.85 24.6 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.237 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.407 ' HD2' HD12 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.4 71.72 0.62 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.287 1.991 . . . . 0.0 111.949 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 50.84 38.98 21.25 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.857 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.563 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 25.2 mt -95.42 9.87 38.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.313 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.35 -141.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.733 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.45 -25.03 7.53 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.654 -178.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -156.38 12.28 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.46 0.171 . . . . 0.0 111.362 178.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.784 HG21 HG13 ' A' ' 115' ' ' VAL . 88.0 mt -76.19 -89.23 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 119.811 -0.755 . . . . 0.0 110.202 178.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.974 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.38 -40.64 59.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.075 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.66 -32.4 54.04 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.31 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.763 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -83.92 -23.12 31.32 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.815 0.341 . . . . 0.0 110.199 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.603 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.39 -6.66 2.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.389 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.589 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.7 mm? -105.14 24.25 12.33 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 176.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.3 pt-20 -166.86 1.73 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.704 -178.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.903 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.98 -151.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.376 0.608 . . . . 0.0 111.826 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.9 t0 -59.23 -3.44 0.4 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.143 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.596 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.3 m-20 78.08 -28.61 0.16 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.509 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.2 m -74.72 -25.15 58.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.903 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.5 OUTLIER -82.64 -26.15 32.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.596 177.251 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 94' ' ' LEU . 2.7 tp -75.06 -25.91 59.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.467 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.1 -47.64 9.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.065 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.417 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.74 -37.87 82.76 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.3 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.705 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.22 -35.97 72.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.268 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.588 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.5 mt -87.05 -12.85 46.08 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.259 0.552 . . . . 0.0 110.068 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 57.6 mm-40 -102.49 -8.01 21.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.19 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.834 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -147.32 134.5 10.22 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.677 0.275 . . . . 0.0 111.722 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 59.4 Cg_endo -72.18 2.19 5.22 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.69 2.26 . . . . 0.0 112.24 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 113' ' ' SER . 5.7 mt-10 -126.71 -13.7 5.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.576 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.834 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -73.11 -45.13 58.79 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.045 0.45 . . . . 0.0 110.051 177.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.791 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.0 tt -56.88 -30.74 64.17 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.119 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -89.76 -44.75 9.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.301 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -68.03 -35.66 78.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.699 -179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.573 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 23.7 mmtt -78.79 -29.42 44.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.49 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.784 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.56 -52.19 31.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.473 ' CG ' ' HE2' ' A' ' 82' ' ' HIS . 7.0 t70 -59.0 -34.88 72.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.394 177.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -29.26 48.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.868 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.763 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.99 -25.31 63.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.781 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.749 HG11 ' ND1' ' A' ' 82' ' ' HIS . 13.1 t -64.96 -51.49 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.877 177.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.35 -24.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.531 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.69 -31.96 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.82 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.68 -37.1 62.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -77.62 -22.72 50.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.098 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.318 179.635 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.654 HD22 HD22 ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.97 0.414 . . . . 0.0 110.907 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.687 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.12 -169.57 1.5 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.969 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.979 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -56.84 -31.96 65.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -50.64 61.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.676 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -57.75 -36.38 72.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.915 178.716 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.979 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.0 mt -68.22 -41.57 81.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.417 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.71 -12.69 17.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.913 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 m -75.29 -13.56 60.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.62 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.546 ' O ' ' HB2' ' A' ' 66' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.107 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.434 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.7 pttm -90.16 29.74 1.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.448 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.494 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -124.71 -46.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.967 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.677 ' HB2' HD23 ' A' ' 58' ' ' LEU . 43.7 mtm -74.49 -8.98 58.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.696 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.786 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -57.94 -52.53 65.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.66 0.267 . . . . 0.0 111.343 -177.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -123.6 23.54 6.68 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.329 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.494 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 2.2 mt-10 -136.73 2.31 2.64 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.466 0.174 . . . . 0.0 111.461 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.645 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -125.67 -34.52 2.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.656 ' HB3' HD11 ' A' ' 78' ' ' ILE . 2.3 mm? -59.5 -38.48 81.01 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.777 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -26.88 -61.54 0.18 Allowed Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -175.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.777 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 15.9 Cg_exo -69.18 -30.38 25.05 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.078 1.852 . . . . 0.0 112.273 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.9 mt -82.12 -17.6 45.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.972 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.656 HD11 ' HB3' ' A' ' 74' ' ' LEU . 11.4 mm -73.18 -43.18 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.88 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.4 mt-30 -50.88 -19.54 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.892 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.67 -40.18 29.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.886 178.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.487 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.79 -50.86 31.2 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.494 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.743 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.2 m-70 -109.08 153.76 42.38 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.572 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.458 ' HG2' HD13 ' A' ' 85' ' ' LEU . 26.1 Cg_endo -61.74 81.0 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.339 2.026 . . . . 0.0 111.789 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.88 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 42.0 33.47 0.37 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.641 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.537 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.8 mp -87.63 8.92 23.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.878 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.457 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -75.72 40.42 0.19 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.75 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.18 -12.64 81.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.758 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.783 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.1 ttpt -178.0 34.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.868 0.366 . . . . 0.0 110.668 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.811 HG21 HG13 ' A' ' 115' ' ' VAL . 61.7 mt -80.09 -91.88 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.85 -40.59 56.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.997 179.694 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.54 53.91 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.144 -1.026 . . . . 0.0 110.916 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.783 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.39 -25.48 33.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.508 -0.346 . . . . 0.0 110.133 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.623 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.5 mm? -59.83 -7.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.786 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -104.98 27.17 8.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -168.89 2.18 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.596 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.943 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.385 0.612 . . . . 0.0 111.712 -179.723 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.542 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.4 t0 -59.43 -3.05 0.38 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.087 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 78.63 -29.94 0.15 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.493 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -73.61 -27.87 61.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.045 0.45 . . . . 0.0 109.956 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.943 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -79.77 -23.48 42.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.097 177.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.16 -25.23 58.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.833 176.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.736 HD12 HD23 ' A' ' 101' ' ' LEU . 2.6 mp -88.4 -45.56 9.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.085 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.422 ' CD2' ' HE2' ' A' ' 114' ' ' LYS . 1.2 t60 -61.94 -45.95 91.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.759 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.692 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -54.09 -32.74 55.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.409 -179.574 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.813 HD23 HD13 ' A' ' 58' ' ' LEU . 66.5 mt -85.13 -11.68 54.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.801 0.334 . . . . 0.0 111.154 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -110.18 -6.12 15.16 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.549 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -146.8 140.18 14.86 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.678 -0.409 . . . . 0.0 112.064 -178.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.57 ' O ' HG21 ' A' ' 54' ' ' THR . 77.0 Cg_endo -77.01 3.69 6.41 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.668 2.246 . . . . 0.0 112.056 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -122.01 -22.61 5.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.536 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.549 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.2 p -64.35 -56.94 11.03 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 109.959 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.9 tt -51.64 -28.3 13.99 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.734 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.426 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.9 ttt85 -89.86 -60.82 1.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.08 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.426 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 50.3 m -55.65 -34.99 65.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.075 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.563 ' HD3' ' HB3' ' A' ' 100' ' ' GLU . 9.1 mttm -79.2 -32.99 44.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.714 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.811 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -66.54 -53.61 33.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 177.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.89 -35.72 69.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.375 178.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.09 -30.16 60.84 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.948 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.98 -19.64 61.85 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.615 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.743 HG11 ' ND1' ' A' ' 82' ' ' HIS . 18.1 t -68.49 -49.16 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.674 176.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.2 -27.38 63.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.603 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.32 -31.92 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.477 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.69 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.99 -41.92 73.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.826 178.697 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.509 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mm100 -68.82 -27.92 66.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.413 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.891 179.065 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.662 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.735 0.302 . . . . 0.0 110.844 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.573 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -173.51 -174.27 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.278 178.42 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 1.044 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.66 -42.13 44.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.793 -178.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.8 m -59.24 -52.3 66.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 110.679 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.449 ' O ' ' HE1' ' A' ' 69' ' ' MET . 0.0 OUTLIER -57.8 -40.24 79.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.044 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.9 mt -61.65 -44.33 97.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.048 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -16.53 51.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.976 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.2 t -73.93 -7.03 50.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.194 179.886 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.917 0.389 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.636 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.32 24.16 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.111 179.746 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.443 ' N ' HD21 ' A' ' 70' ' ' LEU . 16.2 tt0 -131.72 -52.82 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.544 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -77.62 15.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.296 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.815 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -88.86 -28.86 20.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.266 0.555 . . . . 0.0 110.139 179.267 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.053 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.77 11.61 5.15 Favored Glycine 0 N--CA 1.441 -0.988 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.597 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -130.74 -0.69 4.29 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.544 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.17 -21.3 3.95 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.9 0.381 . . . . 0.0 110.702 179.385 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.662 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.09 -15.14 60.16 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.032 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.706 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 3.0 t80 -40.06 -54.6 4.36 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.272 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 12.6 Cg_exo -70.33 -22.59 29.27 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.175 1.916 . . . . 0.0 112.125 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.0 OUTLIER -79.61 -31.5 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.717 -178.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.772 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 7.0 mm -68.69 -42.44 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.855 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.934 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.1 mt-30 -50.78 -18.26 0.7 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.323 0.582 . . . . 0.0 110.366 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.0 -41.58 20.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.835 178.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.772 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.5 OUTLIER -69.19 -43.71 73.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.464 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.784 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 3.4 m-70 -118.78 149.38 46.38 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.302 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.798 ' HG2' HD13 ' A' ' 85' ' ' LEU . 20.8 Cg_endo -59.67 77.68 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.299 2.0 . . . . 0.0 111.594 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.934 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 16.3 p 47.02 35.54 3.45 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.87 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 83' ' ' PRO . 0.8 OUTLIER -89.04 2.89 53.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.235 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -61.26 -114.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.756 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.597 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 63.39 -1.37 2.19 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.121 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.741 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -175.98 -20.62 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.816 HG21 HG13 ' A' ' 115' ' ' VAL . 69.8 mt -50.17 -84.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -177.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.053 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -53.53 -38.17 63.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.533 0.206 . . . . 0.0 110.949 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.11 -29.81 60.03 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.59 176.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.581 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.3 ttp -76.34 -35.09 58.92 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.072 -0.564 . . . . 0.0 110.021 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.65 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.28 -11.02 1.02 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.77 -177.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.621 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.68 28.25 7.66 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.414 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.0 pt-20 -172.86 2.5 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.827 -178.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.969 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.69 -149.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.433 0.635 . . . . 0.0 111.629 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.598 ' N ' HG12 ' A' ' 96' ' ' ILE . 13.0 t0 -53.16 -10.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.852 176.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.709 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.3 OUTLIER 80.6 -25.08 0.18 Allowed 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.824 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -73.48 -31.02 63.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.969 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -73.18 -33.52 65.47 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.82 177.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.52 ' N ' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -65.72 -24.12 66.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.296 178.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.9 mp -89.51 -48.25 7.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.26 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -37.32 81.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.286 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.672 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -59.72 -35.39 74.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.168 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.815 HD21 HD13 ' A' ' 70' ' ' LEU . 15.3 mt -86.78 -11.3 51.4 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.091 0.472 . . . . 0.0 110.066 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -105.63 -7.89 18.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.37 -175.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.863 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -146.58 131.72 9.05 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.673 0.273 . . . . 0.0 111.595 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 56.4 Cg_endo -70.66 2.54 3.93 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.635 2.223 . . . . 0.0 112.257 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -125.37 -16.66 5.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.699 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.863 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.3 OUTLIER -70.64 -46.55 63.07 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.006 0.431 . . . . 0.0 110.326 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.672 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 6.2 tt -54.28 -27.53 35.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.971 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.89 -51.93 5.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.362 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.1 t -64.23 -33.91 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.797 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.551 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 12.7 mmtp -78.93 -30.21 44.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.482 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.816 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.78 -50.42 49.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -57.32 -39.23 75.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.411 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -73.04 -29.47 63.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.869 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.54 -23.16 61.72 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.851 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.703 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.8 t -65.0 -48.65 83.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.588 0 CA-C-O 121.297 0.57 . . . . 0.0 109.687 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.15 -26.73 63.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.546 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.4 t -84.61 -30.69 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.792 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.741 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.91 -39.57 61.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.797 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.438 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.5 mm100 -65.52 -31.03 71.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.152 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.373 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.177 179.183 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.707 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.762 0.315 . . . . 0.0 110.833 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.784 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -171.29 -169.25 0.71 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.91 179.143 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 1.022 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.59 -30.85 61.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.631 0.253 . . . . 0.0 111.297 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.2 m -67.23 -49.89 62.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.608 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.28 -39.92 84.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.212 0.529 . . . . 0.0 110.212 178.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.022 HD12 ' HA ' ' A' ' 55' ' ' ALA . 12.5 mt -62.7 -45.5 92.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.634 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -15.03 58.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.912 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.3 t -75.29 -10.34 59.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.696 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.52 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.514 179.955 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.984 0.421 . . . . 0.0 110.549 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.585 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -115.92 29.87 7.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.586 179.376 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -137.57 -57.44 0.69 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.544 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.4 OUTLIER -74.45 -8.44 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.902 -178.683 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -40.73 83.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.679 0.276 . . . . 0.0 111.34 -179.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.967 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.72 27.94 3.02 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.451 -0.88 . . . . 0.0 112.579 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -141.2 -0.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.08 -22.62 2.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.642 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.698 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -72.9 -21.29 60.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.319 178.467 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.544 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -38.29 -57.15 1.89 Allowed Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.533 -178.12 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 55.5 Cg_endo -69.76 -20.31 35.0 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.982 1.788 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.645 HD12 ' HB2' ' A' ' 53' ' ' LEU . 65.7 mt -88.75 -19.49 25.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.631 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.698 HG12 ' O ' ' A' ' 74' ' ' LEU . 13.3 mm -73.85 -38.21 49.89 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.659 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.3 mt-30 -53.84 -16.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.923 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.85 -38.47 28.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.973 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.692 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.22 -46.07 57.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.103 0.477 . . . . 0.0 110.715 -179.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -111.88 159.15 34.54 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.762 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.768 ' HG2' HD23 ' A' ' 85' ' ' LEU . 36.4 Cg_endo -64.49 75.86 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.264 1.976 . . . . 0.0 111.871 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.659 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.6 OUTLIER 46.52 38.91 6.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.005 -178.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.9 OUTLIER -93.83 4.27 54.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.015 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.48 62.91 1.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.178 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -96.6 -8.05 57.52 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.5 tptt -177.48 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.891 -0.655 . . . . 0.0 110.158 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.824 HG21 HG13 ' A' ' 115' ' ' VAL . 68.1 mt -79.94 -88.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.359 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.967 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -52.7 -39.98 62.51 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.522 0.201 . . . . 0.0 111.014 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.17 -29.56 52.65 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.582 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.729 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.7 ttp -76.75 -33.66 58.1 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.107 -0.547 . . . . 0.0 109.988 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.47 -5.22 0.75 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.702 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.715 HD21 HD13 ' A' ' 70' ' ' LEU . 2.1 mm? -110.3 27.33 9.73 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -170.57 3.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.018 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.913 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -150.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.338 0.59 . . . . 0.0 111.512 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.567 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.4 t70 -59.52 -3.01 0.39 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.192 177.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.575 ' H ' HG12 ' A' ' 96' ' ' ILE . 15.4 m120 78.66 -29.72 0.15 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.48 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -32.94 65.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.44 . . . . 0.0 109.938 178.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.913 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -74.16 -23.83 59.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.876 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.435 ' CB ' HD11 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -75.18 -24.7 57.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.892 177.168 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.2 mp -90.2 -45.02 9.37 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.324 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -37.13 82.35 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.936 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.612 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -59.61 -35.87 75.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.285 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 58' ' ' LEU . 15.5 mt -87.1 -9.07 56.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.07 0.462 . . . . 0.0 110.058 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -108.93 -5.05 16.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.399 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.855 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.7 OUTLIER -148.54 129.52 7.04 Favored Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.673 -179.411 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.18 0.48 3.24 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.849 2.366 . . . . 0.0 112.555 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -126.31 -19.93 4.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.784 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.855 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -64.03 -47.94 78.27 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.325 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.784 ' HB3' HG22 ' A' ' 54' ' ' THR . 3.8 tt -50.39 -22.86 2.04 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.769 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -94.16 -62.87 1.26 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.196 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.0 t -50.23 -29.42 9.43 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.58 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 14.2 mmtp -81.18 -43.1 19.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.666 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.824 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -64.58 -58.2 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.265 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.431 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -51.02 -41.11 59.6 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.886 0.374 . . . . 0.0 110.83 178.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 113' ' ' SER . 12.5 mt-10 -71.68 -32.83 68.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.219 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.74 -23.05 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.037 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.2 t -65.28 -47.97 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 109.676 176.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.55 -27.68 64.79 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.482 177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.3 t -83.54 -32.42 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.693 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.83 -41.06 65.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.173 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.484 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.3 mm100 -61.74 -36.63 81.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.017 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.595 177.837 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.717 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 121.007 0.432 . . . . 0.0 110.998 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.881 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.08 -175.56 4.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.186 179.019 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 1.001 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.94 -32.68 47.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.342 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.3 m -67.19 -49.05 66.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.602 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.643 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -59.22 -37.04 76.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.318 0.58 . . . . 0.0 110.154 178.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.001 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.3 mt -64.51 -44.31 91.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.563 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.25 -10.4 41.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.577 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -75.37 -2.92 30.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.831 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 121.3 0.571 . . . . 0.0 110.658 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.641 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.94 19.52 4.82 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.319 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -116.91 -38.44 3.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.355 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.5 mtm -80.76 -7.73 59.47 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.894 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -60.71 -35.64 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -178.558 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -143.01 28.26 2.13 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.096 -1.05 . . . . 0.0 112.988 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -139.27 -6.53 1.38 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.778 0.323 . . . . 0.0 111.16 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.527 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.0 tmt_? -127.68 -19.48 4.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.132 0.491 . . . . 0.0 109.898 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.59 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -77.78 -26.35 49.69 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.76 178.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.536 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -38.75 -52.71 3.57 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.316 -177.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 14.2 Cg_exo -71.17 -22.78 25.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.289 1.993 . . . . 0.0 112.819 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.717 HD12 ' HB2' ' A' ' 53' ' ' LEU . 58.4 mt -88.02 -23.17 23.87 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.765 HG13 ' HB ' ' A' ' 90' ' ' THR . 5.6 mm -72.16 -37.49 59.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 110.413 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.848 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.7 mt-30 -54.2 -14.75 1.22 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.283 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.12 -36.66 22.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.843 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.47 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.43 -35.27 68.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.015 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.694 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.2 m-70 -121.91 162.09 38.86 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 -179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.07 72.3 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.625 2.217 . . . . 0.0 111.948 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.848 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 51.11 24.76 2.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.287 -179.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 9.1 mt -85.39 5.15 32.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.936 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.699 ' HB3' ' HG3' ' A' ' 79' ' ' GLN . . . -83.01 47.55 1.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.259 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -91.76 12.47 69.33 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.004 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.934 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 5.1 ttpt -177.58 -13.51 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.832 HG21 HG13 ' A' ' 115' ' ' VAL . 36.7 mt -49.85 -82.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.49 -38.12 63.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.509 0.195 . . . . 0.0 110.786 -178.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.65 -28.85 65.95 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.48 176.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.934 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.5 ttm -75.85 -38.24 58.19 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.458 0.647 . . . . 0.0 109.885 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.674 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -54.7 -9.55 0.35 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.486 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.894 HD11 HD13 ' A' ' 70' ' ' LEU . 5.0 mp -105.74 28.55 7.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.431 ' H ' ' H ' ' A' ' 96' ' ' ILE . 9.8 pt-20 -172.43 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.407 -178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.987 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.32 -150.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.323 0.583 . . . . 0.0 111.734 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -57.72 -5.7 0.42 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.858 177.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.559 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-20 79.62 -25.63 0.18 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.236 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.4 50.78 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.987 ' HB2' HG13 ' A' ' 96' ' ' ILE . 3.9 mt-10 -76.07 -24.28 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.776 177.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.707 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -75.2 -26.03 58.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.023 177.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 mp -90.72 -44.95 9.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.038 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.53 -41.65 96.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.04 -178.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.787 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.0 ptm -56.75 -37.5 71.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.812 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.842 HD23 HD13 ' A' ' 58' ' ' LEU . 56.5 mt -80.44 -11.61 59.66 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.232 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -4.4 14.38 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.761 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -144.2 134.65 12.08 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.164 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.574 ' O ' HG21 ' A' ' 54' ' ' THR . 7.8 Cg_exo -72.92 3.55 4.37 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.984 2.456 . . . . 0.0 111.671 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 113' ' ' SER . 28.5 mt-10 -126.15 -14.41 6.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.656 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.761 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -76.28 -47.21 24.57 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.002 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.881 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.78 -40.4 13.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.429 176.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 112' ' ' ARG . 0.3 OUTLIER -81.88 -65.53 1.0 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.573 -179.44 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.513 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -47.43 -49.72 24.52 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -178.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.5 mmtp -64.24 -30.96 71.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.193 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.832 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.78 -56.48 10.64 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.068 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.123 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -54.91 -35.68 64.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.021 0.438 . . . . 0.0 110.408 178.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.97 -32.05 61.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.088 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.623 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.4 -28.99 67.58 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.835 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.694 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -59.68 -49.02 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.158 0.504 . . . . 0.0 109.787 177.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.37 -25.92 51.21 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.701 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 9.9 t -86.64 -30.77 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.846 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.719 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.09 -41.02 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.996 179.275 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.481 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 15.1 mm100 -65.27 -35.06 79.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.004 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.52 177.678 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.785 0.326 . . . . 0.0 111.022 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.94 -174.95 3.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.585 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.51 -31.14 14.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.61 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -67.96 -46.85 70.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.865 0.364 . . . . 0.0 110.473 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.822 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.13 -38.12 75.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.787 178.373 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.641 ' HG ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -64.71 -43.52 93.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 178.159 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.89 -2.07 13.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.088 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 57' ' ' MET . 74.5 m -86.0 -8.5 57.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.886 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.336 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 179.392 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.447 ' O ' HD21 ' A' ' 70' ' ' LEU . 2.9 tt0 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.862 0.363 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.7 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -123.14 37.56 4.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.935 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -128.19 -50.26 1.31 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.679 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.551 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 15.4 mtm -74.46 10.17 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 111.726 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 1.058 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.57 -62.34 1.56 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.58 0.705 . . . . 0.0 110.391 -179.562 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.012 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -114.66 16.6 18.86 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 112.393 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.54 -8.18 4.63 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -125.97 -17.56 5.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.005 0.431 . . . . 0.0 110.816 -179.582 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.646 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.09 -10.98 59.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.633 -179.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.473 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 10.4 t80 -49.13 -54.04 32.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.771 -178.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.511 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 44.0 Cg_endo -67.29 -13.61 40.04 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.031 1.821 . . . . 0.0 112.079 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.821 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.0 mm? -86.39 -42.63 13.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.299 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.809 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.3 mm -60.95 -40.5 85.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.851 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -47.81 -20.45 0.3 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.024 -179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.21 -42.4 15.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.852 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.485 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -68.78 -39.98 79.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.62 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.886 ' CE1' HG21 ' A' ' 119' ' ' VAL . 6.2 m170 -123.5 155.82 65.13 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.932 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.49 ' HD2' HD12 ' A' ' 85' ' ' LEU . 24.6 Cg_exo -63.21 77.22 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 0.0 111.958 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 41.36 30.06 0.12 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.719 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.49 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.7 OUTLIER -85.41 8.38 19.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.779 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.809 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.56 12.55 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.874 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -52.95 -22.22 11.96 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.049 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.724 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -161.34 26.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.907 0.384 . . . . 0.0 111.275 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.872 HG21 HG13 ' A' ' 115' ' ' VAL . 62.8 mt -80.77 -87.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.199 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.012 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.91 -39.31 58.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.224 -179.42 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.15 -31.38 61.94 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.033 -1.08 . . . . 0.0 110.632 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.724 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.9 ttp -74.9 -34.31 62.16 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.081 -0.559 . . . . 0.0 110.083 177.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.685 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -58.37 -7.12 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.249 -177.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.058 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.6 mp -111.62 29.06 8.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 176.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 11.0 pt-20 -167.99 0.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.038 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 1.006 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.73 -148.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.488 0.661 . . . . 0.0 111.382 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -57.74 -6.29 0.5 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.7 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.741 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 78.57 -31.58 0.15 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.276 -179.302 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.52 -29.69 69.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.885 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 1.006 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -74.86 -35.52 62.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.107 177.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.631 ' HG ' HD12 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -65.32 -30.04 70.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.03 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.631 HD12 ' HG ' ' A' ' 101' ' ' LEU . 5.4 mp -81.79 -47.65 12.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.352 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -43.64 92.01 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.529 -177.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.827 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -55.92 -34.16 65.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.625 -179.078 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.663 HD21 ' HB3' ' A' ' 70' ' ' LEU . 21.2 mt -86.25 -11.4 52.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.841 0.353 . . . . 0.0 110.933 -179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.24 -6.52 17.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -177.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.774 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.37 139.12 16.16 Favored Pre-proline 0 C--N 1.332 -0.184 0 C-N-CA 120.454 -0.498 . . . . 0.0 112.153 -178.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.573 ' O ' HG21 ' A' ' 54' ' ' THR . 72.1 Cg_endo -75.78 2.81 6.6 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.606 2.204 . . . . 0.0 111.778 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -125.52 -12.95 6.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.345 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.69 -46.22 19.57 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 177.585 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.46 -40.62 18.69 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.393 176.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -79.32 -61.42 2.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.359 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 28.7 t -50.21 -53.13 30.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -178.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 3.7 mmtp -60.11 -29.8 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.373 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.872 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -72.91 -62.14 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.092 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 7.7 t0 -49.23 -35.12 16.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.995 0.426 . . . . 0.0 110.749 178.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -43.53 61.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.448 178.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.31 65.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.998 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.886 HG21 ' CE1' ' A' ' 82' ' ' HIS . 57.9 t -65.35 -45.88 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.688 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.87 -27.34 65.08 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.428 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 22.4 t -83.07 -33.2 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.477 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.448 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.41 -38.95 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.959 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -67.48 -28.69 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.019 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.204 179.074 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.723 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.838 0.352 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.789 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.69 -163.29 0.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.451 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -57.84 -40.24 79.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.447 -179.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 63.2 m -58.69 -45.69 88.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.871 0.367 . . . . 0.0 110.533 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.723 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.83 -42.2 97.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.28 178.687 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -58.21 -47.29 83.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.57 178.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.67 -10.35 51.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.326 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 57' ' ' MET . 41.5 t -82.45 -7.1 59.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.022 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.58 179.993 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.463 0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -111.8 24.06 13.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.86 178.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -118.62 -53.88 2.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.357 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.415 ' HE3' ' O ' ' A' ' 57' ' ' MET . 4.4 ptt? -81.08 3.82 22.0 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.843 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.21 -42.44 93.5 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.048 179.7 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.042 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.22 34.48 2.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.327 -0.939 . . . . 0.0 112.83 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.51 -3.43 0.72 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.959 0.409 . . . . 0.0 111.196 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.454 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -128.48 -21.56 3.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.117 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.59 -18.71 58.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.365 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -44.61 -56.14 9.0 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.97 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 60.0 Cg_endo -71.76 -8.96 24.1 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.054 1.836 . . . . 0.0 112.092 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.516 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 73.2 mt -97.34 -24.32 15.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.397 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -69.56 -36.91 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 177.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.5 mt-30 -51.6 -15.63 0.49 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.364 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -81.77 -42.61 19.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.611 178.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.697 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.75 -30.63 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.374 179.21 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.676 ' CE1' HG21 ' A' ' 119' ' ' VAL . 15.1 m170 -124.73 156.89 67.67 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.848 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.523 ' HD2' HD12 ' A' ' 85' ' ' LEU . 12.4 Cg_exo -67.7 73.86 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.297 1.998 . . . . 0.0 110.465 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.845 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.3 t 45.0 34.06 1.17 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.112 -177.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.523 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -84.73 2.6 41.25 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.329 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -77.07 60.89 1.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.81 -8.94 61.58 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 177.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.694 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.4 ttpt -176.49 30.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.14 -0.53 . . . . 0.0 110.54 179.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.813 HG21 HG13 ' A' ' 115' ' ' VAL . 64.2 mt -80.2 -90.81 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.323 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.042 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.48 -42.8 55.1 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.122 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.06 -32.7 50.13 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.304 -0.95 . . . . 0.0 111.137 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.725 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.08 -21.32 29.39 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 120.812 0.339 . . . . 0.0 110.405 179.175 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.659 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.0 mm? -61.48 -6.41 2.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.953 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.843 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -104.56 24.8 11.12 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.038 176.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.6 pt-20 -165.85 0.7 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.559 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.915 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.5 -153.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.519 0.676 . . . . 0.0 111.93 -179.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 96' ' ' ILE . 2.2 t70 -58.98 -3.92 0.41 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.17 177.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.84 -35.06 0.14 Allowed 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.156 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -66.14 -26.91 67.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.915 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -83.4 -24.68 31.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.503 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.2 tm? -74.86 -26.25 59.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.546 176.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.8 mp -88.75 -46.1 9.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.422 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -68.02 -36.25 79.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.644 -177.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.668 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 7.0 ptm -60.8 -34.92 75.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 110.941 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD23 ' A' ' 70' ' ' LEU . 27.5 mt -84.32 -13.77 51.51 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.799 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.67 -10.67 16.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.849 -177.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.829 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -139.37 131.88 15.33 Favored Pre-proline 0 C--N 1.33 -0.258 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.969 -178.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.597 ' O ' HG21 ' A' ' 54' ' ' THR . 7.1 Cg_exo -73.35 7.81 2.06 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.976 2.45 . . . . 0.0 111.859 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -127.59 -27.65 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.254 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.829 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.47 -49.26 74.34 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.789 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.8 tt -50.43 -32.9 19.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.31 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -59.32 2.34 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.379 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -57.28 -34.15 68.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.815 0.341 . . . . 0.0 111.175 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 20.0 mmtt -78.76 -29.2 45.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.354 179.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.813 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.46 -53.14 23.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.042 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.41 ' N ' HG12 ' A' ' 115' ' ' VAL . 22.8 t0 -56.85 -36.21 69.75 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.944 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -34.76 60.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.901 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.725 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -63.69 -29.94 71.1 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.446 177.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.676 HG21 ' CE1' ' A' ' 82' ' ' HIS . 23.6 t -55.46 -57.34 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.795 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.426 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -52.25 -24.51 7.44 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.416 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.414 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 10.7 t -87.02 -31.93 6.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.715 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.552 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -71.7 -43.12 66.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.918 178.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.552 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -67.06 -31.44 71.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.107 178.879 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.205 179.262 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.881 0.372 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -170.96 -177.14 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.968 178.308 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 1.014 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.84 -34.43 27.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -48.36 64.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.917 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.591 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -57.89 -41.12 81.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.194 0.521 . . . . 0.0 110.043 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.014 HD12 ' HA ' ' A' ' 55' ' ' ALA . 6.6 mt -63.91 -44.44 92.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.595 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -9.84 11.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.002 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.7 m -84.15 -8.84 58.97 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.999 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.506 179.72 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -99.26 34.91 2.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.1 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 49.4 mm-40 -133.17 -49.84 0.87 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.145 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.547 ' SD ' HD11 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -79.49 -7.73 58.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.909 -178.652 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.885 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -60.95 -34.56 74.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.658 0.266 . . . . 0.0 111.477 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.98 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -138.61 28.69 2.64 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.798 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -137.62 -7.31 1.7 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.866 0.365 . . . . 0.0 111.139 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -19.98 4.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.217 0.532 . . . . 0.0 109.837 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.664 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.44 -31.41 48.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.65 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.526 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.27 -53.49 5.23 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.142 -177.355 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 42.9 Cg_endo -68.21 -21.42 42.0 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.951 1.768 . . . . 0.0 112.138 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.485 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 92.0 mt -88.61 -19.76 25.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.316 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.736 HG13 ' HB ' ' A' ' 90' ' ' THR . 20.8 mm -71.73 -35.99 57.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.91 0.386 . . . . 0.0 110.135 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.487 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.1 OUTLIER -53.35 -17.15 1.66 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.424 0.63 . . . . 0.0 109.895 177.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.08 -38.57 27.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.621 178.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.482 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -69.8 -42.14 74.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.586 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.786 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.5 m-70 -122.25 152.0 59.89 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.953 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.652 ' HG2' HD12 ' A' ' 85' ' ' LEU . 19.8 Cg_endo -57.45 82.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.358 2.038 . . . . 0.0 111.565 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 14.1 t 40.16 37.63 0.42 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.416 -178.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -91.54 7.4 41.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.02 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.84 44.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.586 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.43 -11.64 84.94 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.536 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.639 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -175.57 32.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.851 HG21 HG13 ' A' ' 115' ' ' VAL . 70.7 mt -80.49 -89.44 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.026 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.98 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.17 -42.18 50.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.258 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.45 -31.44 57.12 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.078 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.639 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.96 -23.51 31.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 115.561 -0.319 . . . . 0.0 110.145 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.703 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -60.7 -9.06 3.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.403 178.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.885 HD11 HD13 ' A' ' 70' ' ' LEU . 4.8 mp -105.1 26.51 9.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.585 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 4.8 pt-20 -167.79 1.11 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.3 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.957 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.82 -154.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.486 0.66 . . . . 0.0 111.792 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.421 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.3 t0 -59.54 -2.82 0.38 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.201 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.537 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.79 -35.25 0.17 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.127 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -67.02 -25.82 66.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.89 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.957 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.9 mt-10 -84.18 -24.08 30.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.631 177.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.651 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.4 tp -74.82 -27.21 60.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.388 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -88.1 -47.86 8.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.091 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -63.81 -40.9 97.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.53 -178.586 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.816 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.7 ptm -56.4 -39.03 72.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.562 0.22 . . . . 0.0 111.218 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.765 HD23 HD13 ' A' ' 58' ' ' LEU . 4.5 mt -85.82 -7.55 58.66 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.167 0.508 . . . . 0.0 110.284 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -109.38 -6.51 15.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.966 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.717 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -147.06 129.79 7.87 Favored Pre-proline 0 C--N 1.328 -0.348 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.691 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.9 Cg_exo -67.78 1.32 3.35 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.78 2.32 . . . . 0.0 112.055 179.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.4 -11.22 6.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.527 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.717 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.92 -45.51 23.85 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.2 OUTLIER -46.59 -41.12 14.03 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.482 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 2.4 ttt180 -79.29 -62.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.306 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.4 t -49.74 -54.34 19.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.342 . . . . 0.0 111.221 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.793 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.2 mmtt -58.88 -29.84 67.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.338 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.851 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -73.92 -55.45 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.076 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.46 -33.15 63.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.059 0.457 . . . . 0.0 110.594 178.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -39.24 50.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.551 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.37 66.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.821 177.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.786 HG11 ' ND1' ' A' ' 82' ' ' HIS . 15.6 t -66.82 -50.96 60.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.926 177.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.26 -24.96 58.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.655 177.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.57 -32.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.635 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.35 -36.61 60.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.077 179.331 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.78 -39.44 94.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.41 177.504 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.855 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.872 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.88 179.14 5.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.709 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.582 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -48.39 -40.23 25.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.524 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.7 m -58.55 -47.96 82.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.975 0.417 . . . . 0.0 110.538 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.566 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.14 -42.93 86.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.179 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -59.64 -45.33 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.809 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.92 -12.16 34.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.338 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 m -76.46 -11.41 59.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.313 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.406 179.916 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 120.864 0.364 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.656 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.89 28.79 4.49 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.714 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -131.92 -58.76 0.96 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.077 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.741 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 0.1 OUTLIER -80.7 24.13 0.49 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -87.84 -42.61 12.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.39 0.614 . . . . 0.0 109.717 178.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.054 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -118.77 11.93 11.98 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.057 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -125.67 3.1 7.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.735 -0.232 . . . . 0.0 111.517 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.741 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.16 -33.02 2.68 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.957 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.855 HD22 HD12 ' A' ' 53' ' ' LEU . 2.6 mm? -56.84 -32.8 66.13 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.88 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 4.8 t80 -34.13 -62.58 0.37 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -173.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.88 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.9 Cg_exo -64.25 -17.96 61.58 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.906 1.737 . . . . 0.0 112.281 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.709 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.1 mt -98.53 -18.62 18.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.901 -0.591 . . . . 0.0 112.276 -177.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 8.7 mm -72.73 -46.44 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.937 0.399 . . . . 0.0 110.492 179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.678 ' HG2' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -52.65 -17.34 1.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.178 178.5 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.61 -37.41 36.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.712 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.31 -49.27 23.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.813 -179.321 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.695 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.9 m-70 -107.72 159.39 30.54 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.418 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.651 ' HD2' HD12 ' A' ' 85' ' ' LEU . 19.9 Cg_exo -65.39 72.17 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.524 2.15 . . . . 0.0 111.904 179.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.678 HG23 ' HG2' ' A' ' 79' ' ' GLN . 1.6 m 49.03 39.44 14.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.933 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.651 HD12 ' HD2' ' A' ' 83' ' ' PRO . 14.9 mt -95.83 9.15 41.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.276 -179.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.604 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.11 -140.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.718 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.511 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.27 -12.66 30.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.581 -0.819 . . . . 0.0 111.897 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.757 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -156.63 -23.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.786 HG21 HG13 ' A' ' 115' ' ' VAL . 56.9 mt -50.33 -84.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.227 -0.115 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.054 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -55.34 -36.84 66.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.674 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.03 -29.23 59.16 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.595 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.4 ttp -76.45 -35.65 58.36 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.019 -0.591 . . . . 0.0 109.672 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.732 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.6 mm? -58.62 -6.93 0.81 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.72 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.684 ' HA ' HD12 ' A' ' 101' ' ' LEU . 1.3 mm? -108.14 27.17 9.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.4 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -170.78 3.21 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.334 -178.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.896 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -151.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.346 0.593 . . . . 0.0 111.691 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.57 -2.59 0.36 Allowed 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.092 177.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 71.1 m-20 78.16 -27.84 0.16 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.377 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -31.5 60.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.001 0.429 . . . . 0.0 110.008 178.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.896 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.1 mt-10 -75.32 -23.71 57.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.786 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.805 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.04 -23.63 58.15 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.862 177.06 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.805 HD12 HD23 ' A' ' 101' ' ' LEU . 2.4 mp -92.47 -42.45 9.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.266 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.53 -39.55 85.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.273 -178.67 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.846 ' HB2' HD22 ' A' ' 111' ' ' LEU . 6.3 ptm -57.68 -33.61 68.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD13 ' A' ' 70' ' ' LEU . 12.6 mt -87.15 -10.54 52.46 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.917 -179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.93 -8.1 14.52 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -177.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.694 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -139.9 132.64 15.04 Favored Pre-proline 0 C--N 1.33 -0.263 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.883 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 61.1 Cg_endo -72.03 4.56 3.15 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.663 2.242 . . . . 0.0 112.03 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 113' ' ' SER . 65.4 mt-10 -127.3 -13.09 5.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.494 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.694 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.51 -46.91 20.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.872 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.93 -40.7 14.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -66.1 0.93 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 3.9 m -47.06 -47.7 22.58 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.737 0.304 . . . . 0.0 111.429 -178.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 9.4 mmtt -64.69 -33.47 76.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.786 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -69.16 -55.05 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.3 t70 -54.04 -38.16 64.91 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.95 0.405 . . . . 0.0 110.456 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -75.2 -31.19 60.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.128 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.77 -21.21 62.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.946 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.695 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -67.77 -48.78 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.581 0 N-CA-C 109.479 -0.564 . . . . 0.0 109.479 176.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.6 -22.65 56.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.101 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 43.1 t -86.46 -33.99 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.46 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.757 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.97 -38.68 72.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.606 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -69.67 -28.85 66.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.907 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.97 179.108 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.754 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.794 0.33 . . . . 0.0 111.015 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.844 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.56 -165.5 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.2 179.321 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -55.93 -38.21 69.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -60.09 -47.19 86.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.51 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.754 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.17 -43.78 87.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.178 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -57.24 -48.68 78.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.545 178.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.14 -3.58 20.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 57' ' ' MET . 36.2 t -88.26 -7.48 56.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.665 -179.92 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.975 0.417 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.431 ' H ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -105.26 36.51 2.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.51 178.507 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -136.06 -63.56 0.64 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.032 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.502 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 3.3 ptt? -81.44 22.53 0.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.942 HD23 ' H ' ' A' ' 70' ' ' LEU . 1.2 pt? -79.83 -43.47 22.32 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.889 -0.325 . . . . 0.0 111.18 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.008 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -140.49 31.84 2.2 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.331 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -140.66 -7.83 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.653 0.263 . . . . 0.0 111.241 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.27 -14.36 5.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.596 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -75.48 -15.61 60.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.212 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.676 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -47.29 -56.27 13.05 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.781 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.676 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 34.8 Cg_exo -60.35 -11.94 18.38 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.04 1.826 . . . . 0.0 112.272 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.588 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.7 mm? -98.47 -29.05 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.65 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.759 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.2 mm -65.47 -38.11 81.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 120.773 0.321 . . . . 0.0 111.185 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.941 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 20.2 mt-30 -52.02 -17.72 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.578 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.7 -37.25 22.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.276 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.759 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.24 -35.72 61.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.068 0.461 . . . . 0.0 110.682 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.791 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -126.08 155.84 72.86 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.696 -179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.558 ' HD2' HD12 ' A' ' 85' ' ' LEU . 25.1 Cg_exo -62.37 74.32 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.493 2.129 . . . . 0.0 111.854 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.941 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.2 p 48.37 31.4 2.72 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.987 -178.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -83.67 4.97 26.26 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.17 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.66 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.89 -138.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.878 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.24 -16.4 23.41 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.667 -0.777 . . . . 0.0 111.683 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.889 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.7 ttpt -156.02 -20.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.84 HG21 HG13 ' A' ' 115' ' ' VAL . 60.0 mt -50.35 -81.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.008 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.27 -39.79 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.513 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.96 -28.11 60.43 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 176.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.889 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.6 ttm -76.71 -38.1 54.94 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.41 0.624 . . . . 0.0 109.617 176.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -57.85 -5.82 0.46 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.334 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.862 HD21 ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.6 27.37 9.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.569 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.461 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -170.14 1.29 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.211 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.945 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.18 -152.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.402 0.62 . . . . 0.0 111.654 -179.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 96' ' ' ILE . 1.8 t70 -59.58 -3.22 0.44 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.058 177.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.608 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.15 -34.91 0.16 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 123.733 0.645 . . . . 0.0 111.234 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -29.18 68.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.938 178.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.945 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -79.67 -26.23 41.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.802 177.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.561 HD12 HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -74.82 -27.17 60.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.618 176.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.88 -46.87 10.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.301 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.9 -39.94 87.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.118 -178.648 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.776 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -56.52 -34.13 66.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.521 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 23.0 mt -85.67 -12.98 49.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.506 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -107.8 -2.05 20.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.37 -177.323 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.808 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -150.07 132.64 8.14 Favored Pre-proline 0 CA--C 1.53 0.207 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 54' ' ' THR . 16.6 Cg_exo -68.48 -1.66 7.8 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.933 2.422 . . . . 0.0 112.139 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -116.96 -29.38 6.01 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.057 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.808 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -62.11 -42.19 98.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.203 -178.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.844 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.8 tt -59.77 -25.39 64.86 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.669 -0.413 . . . . 0.0 111.176 179.303 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.7 mtp180 -95.92 -66.09 0.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.923 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.53 ' HG ' ' HG3' ' A' ' 109' ' ' GLU . 1.5 m -42.82 -33.99 0.86 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.961 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 38.7 mmtt -81.77 -43.26 18.6 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.144 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.84 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.19 -58.4 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.49 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.46 -41.75 53.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.19 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -73.17 -31.07 64.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.066 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.799 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.29 -27.71 66.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.63 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.791 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.4 t -59.41 -53.15 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.611 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -54.27 -23.68 15.88 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.065 177.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 12.3 t -86.71 -30.96 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.65 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.793 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.51 -41.18 61.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.208 179.059 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.541 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -70.17 -28.71 65.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.401 0.62 . . . . 0.0 110.078 179.156 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.649 179.93 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.813 0.34 . . . . 0.0 110.972 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.874 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -167.52 -175.42 2.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.305 179.401 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.14 -34.14 21.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.278 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 20.0 m -64.01 -44.79 91.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.627 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.823 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.25 -42.04 97.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.207 178.858 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -61.88 -44.5 96.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.759 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.71 -12.41 58.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.292 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.2 m -76.92 -16.77 59.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.059 179.549 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.861 0.362 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HA ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -117.29 41.33 2.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.743 179.339 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -136.46 -54.66 0.74 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.281 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.446 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.3 ptt? -80.54 -1.84 43.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.784 -178.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.81 -43.12 99.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.591 0.234 . . . . 0.0 111.559 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.986 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.48 28.24 3.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.349 -0.929 . . . . 0.0 112.684 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -140.91 -2.97 1.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 0.0 111.194 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.35 -23.1 3.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.059 0.457 . . . . 0.0 110.721 -179.819 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.04 -22.47 59.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.812 -178.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.679 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -44.95 -56.35 9.08 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.968 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.679 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.1 Cg_exo -61.12 -15.14 37.65 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.031 1.821 . . . . 0.0 112.371 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.725 HD12 ' HB2' ' A' ' 53' ' ' LEU . 82.9 mt -98.64 -25.51 14.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.909 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.7 mm -65.23 -38.64 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-O 121.009 0.433 . . . . 0.0 110.667 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.709 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.0 mt-30 -53.64 -14.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.827 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -88.2 -30.46 19.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.189 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.493 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -84.0 -46.63 11.83 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -173.554 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.771 ' N ' ' HA ' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -80.64 -35.57 0.86 Allowed Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 -171.309 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.771 ' HA ' ' N ' ' A' ' 82' ' ' HIS . 42.1 Cg_endo -96.41 -76.24 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.028 0 CA-C-N 120.65 1.268 . . . . 0.0 112.675 2.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.709 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.9 m -68.08 76.46 0.23 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.696 -178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 84' ' ' THR . 0.4 OUTLIER -145.68 10.33 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.43 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.601 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.79 42.43 0.3 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.448 -177.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -12.59 64.28 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.045 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.807 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.8 ttpt 177.04 36.9 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.042 0.449 . . . . 0.0 110.091 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.903 HG21 HG13 ' A' ' 115' ' ' VAL . 67.4 mt -79.72 -90.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.169 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.986 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.3 -39.62 57.27 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.26 -32.17 57.1 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.02 -1.085 . . . . 0.0 110.838 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.807 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.69 -25.57 32.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.367 178.637 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.617 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.3 mm? -59.6 -7.92 1.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.732 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 70' ' ' LEU . 1.8 mm? -106.19 27.33 8.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.5 pt-20 -166.43 1.53 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.463 -178.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.968 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.83 -151.48 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.384 0.611 . . . . 0.0 111.73 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.541 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.2 t0 -59.08 -3.83 0.42 Allowed 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.085 178.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-80 79.55 -29.03 0.14 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.544 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -32.6 61.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.168 0.509 . . . . 0.0 109.827 178.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.968 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.8 mt-10 -74.08 -23.49 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.999 177.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.477 ' CB ' HD11 ' A' ' 96' ' ' ILE . 1.5 tp -74.86 -25.64 59.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.863 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -88.27 -47.05 8.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.239 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.517 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.4 OUTLIER -63.12 -41.26 99.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.055 -178.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.862 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.6 OUTLIER -56.1 -34.0 65.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.348 -179.736 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.557 ' HA ' HD23 ' A' ' 58' ' ' LEU . 15.0 mt -87.15 -8.63 56.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.039 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 2.6 pt-20 -111.85 -7.98 14.15 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.68 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.42 131.7 14.08 Favored Pre-proline 0 C--N 1.331 -0.196 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.782 -179.134 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.575 ' O ' HG21 ' A' ' 54' ' ' THR . 16.7 Cg_exo -67.58 1.2 3.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.808 2.339 . . . . 0.0 112.103 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -127.19 -11.69 5.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.5 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.68 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -75.24 -46.16 35.6 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.292 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.874 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.48 -29.83 3.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.653 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -95.22 -64.06 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.076 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 27.8 t -46.24 -31.56 2.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.967 0.413 . . . . 0.0 109.981 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 15.8 mmtm -80.75 -41.05 24.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.88 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.903 HG13 HG21 ' A' ' 89' ' ' ILE . 1.5 t -64.38 -63.0 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.305 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.511 ' N ' HG12 ' A' ' 115' ' ' VAL . 9.6 t70 -48.84 -40.07 27.97 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 111.081 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.0 -35.61 66.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.796 0.332 . . . . 0.0 110.454 179.49 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.28 68.29 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.834 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.826 HG13 HD23 ' A' ' 122' ' ' LEU . 12.9 t -63.79 -47.76 89.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.141 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.58 37.09 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.455 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.8 t -87.13 -34.54 7.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.062 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.826 HD23 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -65.58 -33.56 76.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.335 178.209 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -79.82 -24.76 41.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.703 177.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.243 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.794 178.233 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.95 HD22 ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.891 0.377 . . . . 0.0 111.186 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.884 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.95 -168.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.331 179.308 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -54.79 -38.91 67.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.507 -179.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.42 -45.92 91.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 0.0 110.419 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.849 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.49 -43.14 88.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.065 178.688 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.15 -48.16 81.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.476 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.01 -2.6 15.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.355 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' ' 57' ' ' MET . 27.7 t -88.99 -6.98 56.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.315 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.717 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -120.58 30.34 6.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.804 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -131.69 -53.6 1.0 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.437 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.567 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -77.26 2.4 15.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.674 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.747 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -68.4 -39.49 81.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.611 -179.759 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.069 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.4 27.76 2.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.591 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -139.59 -10.16 1.22 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.618 0.247 . . . . 0.0 111.27 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.579 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.9 tmt_? -127.35 -14.82 5.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.307 . . . . 0.0 110.774 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.95 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.77 -14.63 59.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.484 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.643 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 5.6 t80 -49.39 -55.03 24.35 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.531 -178.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.4 Cg_exo -61.69 -9.35 13.51 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.083 1.855 . . . . 0.0 112.455 -179.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.69 -35.41 10.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.699 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.7 mm -60.09 -40.72 84.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.855 0.359 . . . . 0.0 110.601 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.779 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.2 mt-30 -49.19 -19.16 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.879 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.63 -41.63 17.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.908 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.449 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.31 -38.72 75.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.331 0.586 . . . . 0.0 110.412 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.717 ' CE1' HG21 ' A' ' 119' ' ' VAL . 5.3 m170 -121.71 148.69 51.37 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.442 -177.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.809 ' HD2' HD12 ' A' ' 85' ' ' LEU . 37.8 Cg_exo -60.33 74.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.441 2.094 . . . . 0.0 111.699 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.779 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.7 OUTLIER 48.83 28.33 1.88 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.643 -178.048 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.809 HD12 ' HD2' ' A' ' 83' ' ' PRO . 3.1 mt -80.69 2.41 26.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.146 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -68.05 -131.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.585 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.58 -18.55 6.97 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.045 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.864 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.3 ttpt -156.34 -20.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 70.1 mt -49.81 -79.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.069 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.78 -40.14 69.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.457 0.17 . . . . 0.0 110.824 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.33 -28.39 61.79 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.097 -1.049 . . . . 0.0 110.57 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.864 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.0 ttm -76.12 -36.69 58.72 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.581 0.705 . . . . 0.0 109.79 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.691 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -56.27 -9.47 0.67 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.619 -178.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.747 HD21 HD13 ' A' ' 70' ' ' LEU . 2.4 mm? -106.32 28.34 7.84 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 176.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.7 pt-20 -170.26 0.35 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.662 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.956 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.88 -148.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.464 0.65 . . . . 0.0 111.493 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -53.92 -10.14 0.3 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.99 176.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.698 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.5 m-80 79.87 -22.95 0.25 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.099 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -32.35 59.38 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.956 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -70.48 -29.89 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.864 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.695 HD23 HD22 ' A' ' 94' ' ' LEU . 2.2 tm? -69.36 -27.31 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.197 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.4 mp -87.96 -46.58 9.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.348 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.485 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.12 -39.83 90.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.567 -177.821 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.784 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.3 ptm -57.19 -35.87 70.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.715 0.293 . . . . 0.0 111.122 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.55 ' HA ' HD23 ' A' ' 58' ' ' LEU . 12.5 mt -85.7 -10.09 56.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.9 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.485 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -109.55 -8.51 14.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.175 -177.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.708 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -140.31 131.49 14.12 Favored Pre-proline 0 C--N 1.33 -0.276 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.865 -178.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 14.9 Cg_exo -69.14 2.4 3.21 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.978 2.452 . . . . 0.0 112.029 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -127.3 -11.99 5.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.671 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.708 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -77.16 -45.57 26.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.884 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.64 -41.21 14.37 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.779 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.6 -63.27 1.45 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.296 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -48.71 -55.11 12.31 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.348 . . . . 0.0 111.076 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 17.9 mmtt -57.6 -31.28 66.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.36 -58.63 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 115' ' ' VAL . 23.3 t70 -49.62 -38.92 33.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.285 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -43.99 68.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.187 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.724 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -58.4 -29.05 65.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.936 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.717 HG21 ' CE1' ' A' ' 82' ' ' HIS . 21.6 t -56.91 -51.5 67.4 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.789 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.02 -26.91 28.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.92 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.416 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 9.2 t -86.18 -31.03 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.875 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.76 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.92 -40.71 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.908 179.259 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 16.9 mm100 -61.97 -37.91 86.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.653 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.235 176.641 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.824 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.927 0.394 . . . . 0.0 111.014 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -164.64 -167.92 1.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.329 179.388 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.516 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -56.84 -37.44 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.093 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.1 m -61.12 -43.61 98.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.389 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.824 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -62.26 -41.49 98.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.149 178.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -59.25 -46.13 89.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.546 179.151 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.99 -12.17 61.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.3 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 28.5 t -76.37 -8.63 57.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.832 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.549 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.329 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 121.05 0.452 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.625 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -130.32 25.08 5.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 179.62 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.488 ' N ' HD21 ' A' ' 70' ' ' LEU . 40.7 tt0 -130.25 -58.02 1.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.92 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.631 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -74.0 18.02 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -89.41 -39.46 13.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.119 0.485 . . . . 0.0 110.491 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.05 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.74 16.41 5.34 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.198 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -133.84 -11.09 2.67 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.477 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.585 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.77 -14.05 5.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.843 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.76 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.82 -12.06 59.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.131 179.392 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.735 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.1 t80 -46.81 -54.29 20.66 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.024 -178.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.735 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.1 Cg_exo -62.67 -15.62 47.54 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.205 1.937 . . . . 0.0 112.286 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.637 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.2 mm? -93.25 -28.13 16.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.486 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.771 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.0 mm -70.61 -40.18 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.781 0.324 . . . . 0.0 111.187 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.807 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 17.8 mt-30 -53.29 -16.43 1.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.346 0.593 . . . . 0.0 110.22 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.83 -37.23 22.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.062 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.771 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.17 -35.96 61.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.046 0.45 . . . . 0.0 110.704 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.9 m-70 -125.24 161.98 46.7 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.861 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.81 ' HG2' HD13 ' A' ' 85' ' ' LEU . 45.7 Cg_endo -67.59 72.16 0.66 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.402 2.068 . . . . 0.0 112.041 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.807 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 66.1 p 46.83 41.89 11.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.356 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.81 HD13 ' HG2' ' A' ' 83' ' ' PRO . 2.3 mp -99.15 11.06 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.69 22.33 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.986 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.04 -17.15 35.74 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.657 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.3 ttpt -168.95 29.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.816 0.341 . . . . 0.0 111.06 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.884 HG21 HG13 ' A' ' 115' ' ' VAL . 67.5 mt -80.7 -90.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.07 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.05 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -52.04 -41.73 62.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.07 -32.31 49.64 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.113 -1.042 . . . . 0.0 111.146 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.685 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.69 -22.39 27.87 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 120.908 0.385 . . . . 0.0 110.45 179.437 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.586 ' HA ' HG23 ' A' ' 96' ' ' ILE . 3.9 mm? -60.22 -10.01 4.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.195 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.638 HD23 ' HA3' ' A' ' 71' ' ' GLY . 2.2 mm? -102.91 26.43 8.13 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.3 pt-20 -165.5 -0.62 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.916 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.94 -151.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.397 0.618 . . . . 0.0 111.633 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.7 t0 -53.83 -10.05 0.28 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.151 176.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.751 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.8 OUTLIER 79.16 -23.03 0.26 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.191 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -76.53 -25.98 54.72 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -77.96 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.779 177.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.776 ' HG ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.5 -21.41 66.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.865 178.094 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.776 HD23 ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -88.68 -52.4 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.23 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.6 OUTLIER -63.36 -38.75 92.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.223 -178.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.78 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -56.85 -35.1 68.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.567 HD21 HD13 ' A' ' 70' ' ' LEU . 21.7 mt -86.89 -10.15 54.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.942 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.18 -4.64 15.65 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -177.029 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.815 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -141.93 130.0 11.81 Favored Pre-proline 0 C--N 1.332 -0.192 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.597 -179.918 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.536 ' O ' HG21 ' A' ' 54' ' ' THR . 21.9 Cg_exo -66.47 6.25 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.402 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.4 OUTLIER -131.54 -24.25 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.538 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.815 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.13 -42.62 99.54 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.76 -28.55 2.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.357 175.706 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.9 mtp85 -95.89 -66.63 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.073 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 22.7 t -44.93 -30.36 0.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.306 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -80.79 -42.27 22.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.953 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.884 HG13 HG21 ' A' ' 89' ' ' ILE . 1.9 t -64.25 -60.18 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.279 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.436 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.5 OUTLIER -51.31 -39.61 57.25 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.078 179.442 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.512 ' HB2' ' O ' ' A' ' 113' ' ' SER . 2.1 mt-10 -73.21 -33.9 65.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.916 0.388 . . . . 0.0 110.151 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.685 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.08 -27.46 67.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.668 HG11 ' ND1' ' A' ' 82' ' ' HIS . 22.0 t -60.57 -47.46 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.05 -25.9 59.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.557 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.56 -31.26 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.799 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.6 -40.08 66.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.927 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -64.02 -38.59 91.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.94 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.396 177.221 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.513 HD12 ' CD1' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.863 0.363 . . . . 0.0 111.033 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.916 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -169.8 -177.81 2.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.175 178.312 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.953 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.32 -35.79 51.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.479 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 5.7 m -66.58 -47.91 71.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.364 . . . . 0.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.586 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.17 -41.98 85.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.258 0.551 . . . . 0.0 110.369 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.953 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.1 mt -63.17 -45.94 89.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.812 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.58 -10.34 44.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.488 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -83.15 -8.02 59.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.736 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.182 179.939 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.96 0.41 . . . . 0.0 110.497 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -116.51 36.03 4.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.577 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -126.76 -50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.421 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.481 ' HG3' HD23 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -80.62 -3.38 50.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.642 -178.668 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.771 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.09 -38.57 86.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.39 -179.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.94 28.91 2.78 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.581 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -142.95 0.18 1.19 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.428 ' CB ' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -130.37 -22.62 2.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.692 179.157 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -75.98 -24.88 55.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.826 178.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.467 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -41.14 -55.96 4.58 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.044 -177.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.0 Cg_endo -71.48 -15.37 30.94 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.028 1.819 . . . . 0.0 112.232 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 81.3 mt -92.16 -20.64 21.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.524 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.71 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.6 mm -73.08 -36.17 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HG2' HG22 ' A' ' 84' ' ' THR . 3.7 mt-30 -52.8 -13.06 0.37 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.097 177.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -84.09 -44.42 14.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.9 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.71 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.45 -35.78 73.53 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.526 0.679 . . . . 0.0 110.164 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.683 ' ND1' HD13 ' A' ' 89' ' ' ILE . 5.5 m170 -119.53 139.91 28.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.944 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.429 ' O ' HG23 ' A' ' 84' ' ' THR . 54.7 Cg_exo -30.98 -48.91 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.82 2.347 . . . . 0.0 112.215 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.627 HG22 ' HG2' ' A' ' 79' ' ' GLN . 0.0 OUTLIER 176.59 14.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.89 177.509 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.86 3.87 0.97 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.424 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.729 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.32 47.37 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.247 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.78 -7.32 78.48 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.943 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 4.8 ttpt -174.4 28.35 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.783 0.325 . . . . 0.0 110.977 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 56.1 mt -80.1 -83.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.757 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.1 -40.88 59.43 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.476 0.179 . . . . 0.0 110.669 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.14 -31.76 56.46 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.943 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 4.6 ttm -73.8 -39.34 64.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.272 176.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -54.18 -10.76 0.39 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.843 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.771 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -105.15 28.68 7.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -171.52 -0.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.04 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.996 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.92 -150.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.488 0.661 . . . . 0.0 111.735 -179.325 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.6 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.7 t70 -55.49 -9.35 0.47 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.204 176.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.733 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.3 m120 79.45 -24.64 0.2 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.103 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -74.32 -29.35 61.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.996 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.57 -38.53 62.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.556 176.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.571 ' N ' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -64.23 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.986 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.36 -48.62 7.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.203 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.453 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.1 -41.43 94.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.318 -178.299 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.839 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -56.32 -34.31 66.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.443 -179.354 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.668 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.2 mt -86.66 -11.22 51.95 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.797 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.16 -7.99 15.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.737 0.644 . . . . 0.0 112.737 -176.68 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -141.95 135.73 14.63 Favored Pre-proline 0 C--N 1.332 -0.164 0 C-N-CA 120.598 -0.441 . . . . 0.0 112.008 -178.69 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.503 ' O ' HG21 ' A' ' 54' ' ' THR . 62.5 Cg_endo -72.18 0.52 7.19 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.697 2.265 . . . . 0.0 111.906 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -123.99 -10.89 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.323 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.81 -46.89 17.75 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.095 0.474 . . . . 0.0 109.737 178.059 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.916 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.5 -39.62 16.49 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.163 176.336 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.425 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.5 ttt-85 -80.18 -59.2 2.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.273 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.425 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 3.3 t -52.66 -56.82 12.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.981 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.595 ' HD3' ' HG3' ' A' ' 100' ' ' GLU . 0.8 OUTLIER -55.21 -32.24 62.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.8 t -69.58 -60.96 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.079 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.435 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.7 OUTLIER -50.24 -36.8 32.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 111.176 178.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -38.99 65.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.263 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.635 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -61.85 -30.02 70.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 177.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 115' ' ' VAL . 14.6 t -56.2 -53.74 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.933 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.44 -27.07 22.78 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.928 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 9.2 t -85.68 -31.71 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.954 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -70.82 -43.39 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.815 179.211 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.508 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 18.1 mm100 -68.88 -25.6 64.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.214 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.354 179.264 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.841 HD22 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.007 0.432 . . . . 0.0 111.164 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.68 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.33 -169.06 1.01 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.682 178.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 1.017 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -53.52 -40.26 65.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.665 0.269 . . . . 0.0 111.431 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.5 m -59.27 -51.54 69.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.715 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.581 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.56 -39.11 79.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.296 179.069 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 55' ' ' ALA . 17.8 mt -62.9 -42.89 99.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.89 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.2 -16.72 62.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.148 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.9 m -74.19 -7.21 51.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.357 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.397 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.483 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.08 25.22 12.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 178.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 2.2 mm100 -121.58 -50.76 2.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -81.17 5.97 15.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.92 -178.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.799 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.86 -57.27 8.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 179.816 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.007 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -113.05 33.62 5.49 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.732 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -144.41 -3.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.824 0.345 . . . . 0.0 111.297 -178.686 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.659 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -125.68 -26.26 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.527 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.841 HD22 HD22 ' A' ' 53' ' ' LEU . 1.6 mm? -63.5 -33.14 74.92 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.297 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.796 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.2 t80 -39.2 -60.23 1.27 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.796 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 32.5 Cg_exo -57.92 -19.45 39.8 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 121.851 1.701 . . . . 0.0 112.342 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.537 HD23 ' HB2' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -98.83 -25.96 14.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.318 -178.109 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.679 HG12 ' O ' ' A' ' 74' ' ' LEU . 5.4 mm -65.85 -40.03 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.782 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -51.5 -19.36 1.4 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.521 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.26 -36.85 26.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.837 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.49 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.79 -34.56 64.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.6 m-70 -130.44 148.03 68.3 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.572 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 85' ' ' LEU . 51.2 Cg_exo -55.65 79.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.537 2.158 . . . . 0.0 112.364 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.782 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.0 p 42.89 37.68 1.17 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.529 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 10.8 mt -95.66 12.46 29.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.1 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.471 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.02 24.16 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.558 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.18 -19.14 44.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.681 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.644 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -169.11 32.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.89 0.376 . . . . 0.0 111.012 179.681 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.805 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -80.56 -92.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.888 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.007 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.82 -40.56 56.02 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.01 -31.33 55.78 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.209 -0.996 . . . . 0.0 110.973 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.709 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.79 -22.16 29.67 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 120.864 0.364 . . . . 0.0 110.098 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -62.48 -4.41 1.9 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.195 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -106.61 24.32 12.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.465 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 10.5 pt-20 -166.8 0.83 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.481 -178.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -152.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.554 0.693 . . . . 0.0 111.797 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.459 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.4 t0 -59.27 -3.28 0.38 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.157 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.62 -34.07 0.14 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.244 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -69.18 -24.79 64.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.102 178.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.904 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.3 mt-10 -84.04 -27.05 28.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.427 177.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.1 OUTLIER -74.89 -27.48 60.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.246 175.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.434 HD23 HD23 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -83.92 -48.79 9.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.873 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.534 ' ND1' ' HB3' ' A' ' 110' ' ' SER . 0.2 OUTLIER -61.93 -47.74 83.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.422 -178.57 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.716 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 5.7 ptm -52.15 -36.44 51.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.455 -178.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.81 HD23 HD13 ' A' ' 58' ' ' LEU . 54.4 mt -81.83 -14.71 55.94 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.857 -179.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.479 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.2 -10.61 16.38 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -176.934 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.534 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -143.2 136.27 13.86 Favored Pre-proline 0 N--CA 1.465 0.278 0 C-N-CA 120.283 -0.567 . . . . 0.0 112.241 -178.62 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.561 ' O ' HG21 ' A' ' 54' ' ' THR . 7.6 Cg_exo -73.69 3.88 4.52 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.017 2.478 . . . . 0.0 112.156 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -123.99 -22.07 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.561 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.534 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.4 p -64.05 -55.97 18.32 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.377 0.608 . . . . 0.0 109.857 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.5 tt -48.8 -31.09 6.48 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.572 -179.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.2 ttt85 -88.17 -60.56 1.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.308 -179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.4 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 49.6 m -56.5 -34.75 67.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.122 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -78.5 -31.22 47.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.78 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.805 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.77 -51.71 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -32.96 69.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.336 177.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -79.58 -31.07 41.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.574 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.709 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -68.32 -23.77 64.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.492 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 17.0 t -64.86 -57.24 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.609 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -53.27 -23.78 9.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.885 177.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 24.2 t -86.62 -32.54 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.433 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.68 -43.87 65.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.234 179.207 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.549 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -66.19 -31.5 72.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.829 178.327 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.139 179.133 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.793 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.824 0.345 . . . . 0.0 110.841 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -169.44 -161.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.37 179.229 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.6 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -58.26 -35.38 71.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.394 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 72.9 m -60.39 -49.43 77.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.223 179.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.793 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.22 -42.34 86.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.306 178.659 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.616 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.93 -45.11 91.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.815 179.459 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.27 -16.07 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.337 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.5 t -75.95 -13.52 60.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.744 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.993 179.497 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.9 0.381 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -118.87 39.69 3.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.785 179.55 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -135.82 -59.27 0.76 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.371 -179.572 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -79.89 12.48 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.859 -178.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.807 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -76.62 -40.56 48.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.748 0.309 . . . . 0.0 111.077 179.052 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.047 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -133.7 23.98 3.72 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.224 -0.989 . . . . 0.0 112.693 -179.276 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.61 -7.37 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.708 0.29 . . . . 0.0 111.225 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.8 tmt_? -127.13 -15.25 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.906 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.673 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.11 -8.86 58.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.228 179.524 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.711 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.1 t80 -50.02 -55.82 21.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.445 -178.516 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 19.9 Cg_exo -64.89 -9.64 22.11 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.057 1.838 . . . . 0.0 111.852 179.513 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.784 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.9 mm? -93.22 -34.21 13.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.365 -179.52 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.778 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.5 mm -66.74 -38.87 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.872 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.729 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.4 mt-30 -50.93 -18.25 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.444 0.64 . . . . 0.0 110.198 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -83.82 -43.11 15.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.225 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.71 -38.73 73.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.427 0.632 . . . . 0.0 110.424 -179.898 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.659 ' ND1' HD13 ' A' ' 89' ' ' ILE . 3.9 m170 -121.95 151.24 57.75 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.414 -177.132 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.826 ' HG2' HD23 ' A' ' 85' ' ' LEU . 30.5 Cg_endo -62.58 75.82 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.272 1.982 . . . . 0.0 111.778 179.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.729 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 50.43 28.85 3.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.743 -178.786 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.826 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -80.22 0.62 31.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.375 -178.897 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.756 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.78 -144.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.47 -3.58 86.12 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.915 -179.441 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.73 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -167.82 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.778 -0.211 . . . . 0.0 111.111 -179.826 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.836 HG21 HG13 ' A' ' 115' ' ' VAL . 76.6 mt -49.68 -82.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.689 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.047 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -55.57 -38.12 68.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.597 0.237 . . . . 0.0 110.729 179.748 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.54 -29.05 57.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.686 177.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.591 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.3 ttp -76.88 -33.62 57.82 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.098 -0.551 . . . . 0.0 109.876 177.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.553 ' O ' HD23 ' A' ' 101' ' ' LEU . 4.6 mm? -59.86 -5.2 0.88 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.642 -178.215 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.807 HD11 HD13 ' A' ' 70' ' ' LEU . 3.2 mp -109.08 25.78 11.4 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 176.483 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -169.91 3.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.289 -178.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.942 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.06 -151.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.242 0.544 . . . . 0.0 111.66 -179.752 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 6.3 t0 -59.53 -2.48 0.34 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.206 178.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-80 78.0 -28.74 0.16 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.443 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 m -75.32 -27.05 59.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.054 0.454 . . . . 0.0 109.888 178.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.942 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -80.41 -22.19 41.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.938 177.916 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.1 tm? -75.2 -24.98 57.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.723 176.73 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.3 mp -90.25 -45.14 9.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.359 -179.21 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.09 -36.79 80.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.007 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.632 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.87 -36.03 73.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 179.785 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.616 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.7 mt -87.01 -10.47 53.05 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.186 0.517 . . . . 0.0 109.991 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -108.02 -3.46 18.72 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.157 -176.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -150.75 131.46 7.22 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.204 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.485 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.03 -2.02 8.04 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.931 2.42 . . . . 0.0 112.064 179.509 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.463 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -117.31 -28.52 6.12 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.343 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.821 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -62.63 -42.93 99.87 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.469 -178.887 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.9 tt -61.25 -30.6 70.55 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.281 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.528 ' HG2' ' N ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -89.48 -63.52 1.27 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 0.0 110.5 180.0 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.528 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 2.7 m -49.41 -36.85 23.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.386 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.473 ' HD2' ' OE2' ' A' ' 100' ' ' GLU . 33.3 mmtt -80.1 -35.71 36.47 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.044 178.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.836 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.59 -50.23 81.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.561 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.82 -37.16 68.29 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.094 178.304 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -39.67 69.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.85 178.487 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.66 -25.97 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 115' ' ' VAL . 17.0 t -59.68 -53.94 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.496 176.638 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.23 -26.37 28.3 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.918 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.76 -31.03 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.918 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.73 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.95 -41.36 62.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 110.014 179.27 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.533 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 34.7 mm-40 -63.37 -34.3 77.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.879 178.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.437 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.678 177.734 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.695 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.679 0.276 . . . . 0.0 110.811 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.902 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -163.03 -177.19 5.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.771 179.442 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.08 -38.0 36.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.066 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.1 m -61.44 -45.14 95.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.489 179.333 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.695 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.46 -43.38 96.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.057 178.692 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.96 -46.2 88.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.619 179.345 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.34 -9.74 58.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.109 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.3 t -80.76 -8.29 59.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.798 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.076 179.77 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.965 0.412 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -120.0 38.4 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.564 179.199 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 65.2 tt0 -127.81 -56.07 1.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.361 -179.126 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.577 ' HB2' ' HB3' ' A' ' 73' ' ' ARG . 1.2 ptt? -74.91 1.18 13.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -178.816 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.706 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -65.09 -41.52 94.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.672 -179.457 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.022 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.04 26.67 3.39 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.563 -179.119 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -138.98 -4.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.994 0.426 . . . . 0.0 110.895 179.754 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.577 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 4.5 tpm_? -126.99 -24.41 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.987 179.864 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.645 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -74.9 -30.03 61.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.328 179.703 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.482 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.04 -54.67 4.3 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.031 -178.089 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.8 Cg_endo -65.27 -26.28 56.59 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.934 1.756 . . . . 0.0 112.028 178.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 53' ' ' LEU . 63.8 mt -81.57 -20.97 38.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.688 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 15.6 mm -69.53 -36.95 73.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.808 0.337 . . . . 0.0 110.112 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.685 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.2 mt-30 -53.41 -14.78 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 178.049 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.71 -40.42 20.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.698 178.702 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.25 -45.52 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.188 0.518 . . . . 0.0 110.142 179.26 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 9.3 m-70 -112.3 145.51 33.01 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.927 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.508 ' O ' ' HB ' ' A' ' 84' ' ' THR . 18.2 Cg_exo -30.97 -49.08 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.26 2.64 . . . . 0.0 112.456 -179.354 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.685 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 11.6 t 173.85 22.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.938 178.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -72.24 11.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.566 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.468 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -77.03 44.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.477 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -85.69 -10.7 75.77 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.332 177.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.571 ' O ' ' HG3' ' A' ' 88' ' ' LYS . 1.5 tptt -175.11 31.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.245 179.414 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.815 HG21 HG13 ' A' ' 115' ' ' VAL . 62.1 mt -79.58 -89.35 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 120.806 -0.357 . . . . 0.0 110.561 179.119 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.022 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.54 -38.57 60.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 179.241 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.47 -31.91 57.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.993 178.01 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.744 ' HG2' HG22 ' A' ' 96' ' ' ILE . 38.4 ttp -83.37 -23.14 32.57 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.717 -0.241 . . . . 0.0 110.446 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 90' ' ' THR . 4.6 mm? -61.92 -6.18 2.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.497 178.68 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.706 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.99 20.84 17.96 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 176.476 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.673 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -162.52 1.72 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.473 -179.327 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.96 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.06 -152.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 121.35 0.595 . . . . 0.0 111.757 -179.9 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.549 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.4 t70 -59.43 -2.2 0.3 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.262 178.256 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.584 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.3 m-80 78.55 -31.16 0.15 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.53 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -73.1 -29.54 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.02 0.438 . . . . 0.0 109.924 178.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.96 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -78.28 -21.84 49.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.757 177.533 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.65 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.8 tp -75.25 -25.01 57.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.902 176.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.2 mp -90.63 -46.34 8.34 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.286 -179.127 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -37.78 88.74 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.116 -178.926 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.835 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -60.86 -36.67 79.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.55 -179.657 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.6 mt -87.38 -6.03 58.63 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 110.518 179.639 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 58.8 mm-40 -109.5 -13.48 14.56 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.642 -175.701 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -138.3 139.11 24.26 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -176.825 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 8.2 Cg_exo -74.24 19.55 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 112.366 179.571 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.77 -26.14 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.99 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 107' ' ' SER . 0.6 OUTLIER -62.92 -41.25 99.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.58 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.902 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.08 -28.1 1.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.964 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -96.24 -65.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.076 -179.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 31.9 t -46.95 -29.28 1.96 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.374 . . . . 0.0 110.262 179.368 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 39.3 mmtt -80.69 -42.34 22.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.723 177.784 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.815 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -64.79 -60.07 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -49.34 -40.64 36.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.864 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.56 -33.87 64.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.908 0.385 . . . . 0.0 110.338 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.442 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.14 -21.66 64.91 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.975 178.24 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.722 HG22 HD13 ' A' ' 89' ' ' ILE . 24.2 t -67.83 -46.15 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.738 176.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.45 -32.08 72.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.575 177.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 12.2 t -79.41 -30.81 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.614 179.166 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.627 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -74.69 -42.02 59.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.29 179.904 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.405 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.6 mm100 -61.18 -30.66 70.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.707 178.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.467 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.435 177.354 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.589 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.736 0.303 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -169.59 -178.72 3.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.144 178.329 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.985 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.3 -33.68 29.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.7 -47.97 65.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.793 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.554 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.09 -37.82 75.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.491 0.662 . . . . 0.0 109.749 178.431 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.985 HD12 ' HA ' ' A' ' 55' ' ' ALA . 15.7 mt -66.08 -44.15 85.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.638 179.239 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.37 -9.67 35.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.562 178.803 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 57' ' ' MET . 40.1 m -78.94 -5.8 54.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.955 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.455 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.423 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.915 -179.291 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.567 ' C ' HD11 ' A' ' 70' ' ' LEU . 2.3 mt-30 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.974 0.416 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.688 ' C ' HD21 ' A' ' 70' ' ' LEU . 4.8 ptmt -134.67 27.88 3.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.734 179.314 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -135.09 -49.43 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.916 -179.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.438 ' HE1' ' O ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -80.77 3.2 23.14 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -176.863 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.851 HD23 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -75.38 -35.31 61.1 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.107 0.48 . . . . 0.0 109.862 179.375 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.081 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.1 26.99 4.36 Favored Glycine 0 N--CA 1.438 -1.219 0 C-N-CA 119.847 -1.168 . . . . 0.0 112.702 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -144.34 -1.25 0.94 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.763 0.316 . . . . 0.0 111.381 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.0 -22.09 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.313 0.578 . . . . 0.0 109.972 179.118 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.699 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.09 -23.82 47.8 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.499 178.649 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.453 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -36.74 -54.63 1.67 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.438 -178.176 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.4 Cg_endo -72.1 -22.05 23.13 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.034 1.823 . . . . 0.0 112.795 -179.334 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.589 HD12 ' HB2' ' A' ' 53' ' ' LEU . 94.3 mt -89.36 -19.06 25.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.888 -178.73 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.802 HG13 ' HB ' ' A' ' 90' ' ' THR . 9.8 mm -73.79 -40.11 53.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 178.086 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.0 OUTLIER -53.89 -17.09 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.858 177.351 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.49 -37.88 35.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.868 178.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.702 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.25 -47.14 52.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.485 179.973 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.0 m-70 -113.33 148.97 40.74 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.622 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -56.3 79.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.433 2.088 . . . . 0.0 111.981 179.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.504 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 58.4 p 45.57 34.42 1.67 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.154 -178.483 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -89.7 6.95 39.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.016 -179.73 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -80.1 46.92 0.85 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.272 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.52 85.7 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.562 -0.828 . . . . 0.0 111.583 178.315 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.705 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -174.3 29.07 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.92 0.39 . . . . 0.0 110.702 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.933 HG21 HG13 ' A' ' 115' ' ' VAL . 65.8 mt -80.43 -93.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.406 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.081 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -50.67 -40.77 54.54 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.444 -178.925 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.08 -31.51 56.12 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.092 -1.051 . . . . 0.0 111.054 178.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.695 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.99 -22.75 28.98 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 120.846 0.355 . . . . 0.0 110.155 179.412 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.554 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.89 -5.78 2.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.851 HD11 HD23 ' A' ' 70' ' ' LEU . 5.1 mp -108.51 26.7 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.166 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.604 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.3 pt-20 -165.93 -0.21 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.314 -179.267 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.93 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.04 -152.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.366 0.603 . . . . 0.0 111.517 -179.993 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.5 t70 -59.44 -3.84 0.5 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.307 177.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.606 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.9 m-20 77.61 -28.73 0.17 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.356 -179.576 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -74.03 -26.55 60.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.93 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.4 OUTLIER -81.33 -26.49 35.57 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.454 176.985 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -74.96 -25.26 58.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.403 176.242 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.73 -48.43 8.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.214 -179.374 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.554 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -62.76 -42.32 99.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.091 -178.863 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.757 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.49 -33.63 66.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.303 -179.726 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.721 HD23 HD13 ' A' ' 58' ' ' LEU . 25.9 mt -86.76 -10.3 53.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.054 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.72 -8.92 15.29 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.735 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -140.72 133.38 14.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.846 -178.723 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.517 ' O ' HG21 ' A' ' 54' ' ' THR . 60.3 Cg_endo -71.4 3.71 3.41 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.595 2.196 . . . . 0.0 111.803 178.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -126.47 -11.09 6.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -79.06 -46.07 18.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.121 0.486 . . . . 0.0 109.704 177.989 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.54 -40.47 18.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.205 176.097 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 113' ' ' SER . 3.8 ttt180 -80.33 -57.33 3.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.375 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.417 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 42.1 t -53.71 -56.83 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.766 0.317 . . . . 0.0 110.799 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 7.6 mmtm -54.65 -32.81 59.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.933 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -72.11 -58.32 5.34 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.046 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.31 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -31.47 58.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.113 0.482 . . . . 0.0 110.29 178.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -79.95 -32.45 39.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.832 178.408 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.695 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.69 -20.81 63.55 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.746 177.468 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.702 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.5 t -69.48 -47.8 70.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.412 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.3 -25.58 64.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.471 177.03 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 6.2 t -86.05 -34.96 8.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.098 178.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.705 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -67.23 -33.3 75.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.203 178.254 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.58 -27.34 37.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.615 176.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.368 179.295 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.775 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.65 0.262 . . . . 0.0 110.976 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.861 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.98 -175.36 1.21 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.647 178.585 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.49 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.34 -45.77 55.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.591 -179.687 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.7 m -55.9 -45.45 78.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.8 0.333 . . . . 0.0 110.718 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.495 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -60.29 -42.91 96.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.377 178.964 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.68 -46.9 86.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.338 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.46 -9.48 53.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.026 179.65 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.2 t -82.22 -9.17 59.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.003 -179.615 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.419 179.878 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.717 0.294 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.629 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -127.15 26.33 6.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.032 179.686 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.489 ' N ' HD21 ' A' ' 70' ' ' LEU . 2.6 tt0 -128.34 -53.28 1.28 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.42 ' HB2' ' CB ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -78.58 20.5 0.43 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.155 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.822 HD13 HD21 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -89.65 -53.43 4.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.168 0.508 . . . . 0.0 110.385 179.698 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.074 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -108.32 18.66 32.85 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.379 -0.915 . . . . 0.0 111.775 178.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.78 -10.59 2.07 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.338 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.549 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.55 -15.38 5.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.571 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.726 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -78.13 -12.67 60.01 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.526 179.968 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.4 t80 -49.64 -54.55 30.13 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.768 -177.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 26.3 Cg_exo -63.27 -7.88 13.16 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.139 1.892 . . . . 0.0 112.329 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.775 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.1 mm? -98.63 -37.46 9.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.65 -179.178 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.597 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.5 mm -61.1 -42.46 93.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-O 120.717 0.294 . . . . 0.0 110.942 -179.626 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.8 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 7.3 mt-30 -48.88 -18.79 0.31 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.956 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.49 -40.14 18.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.255 179.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.479 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.53 -35.47 68.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.347 0.594 . . . . 0.0 110.601 179.674 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.706 ' CE1' HG21 ' A' ' 119' ' ' VAL . 7.2 m170 -121.61 157.44 56.75 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.649 -177.037 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.501 ' HD2' HD13 ' A' ' 85' ' ' LEU . 16.3 Cg_exo -67.29 69.08 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.488 2.126 . . . . 0.0 111.586 179.031 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.8 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.5 OUTLIER 52.41 24.2 2.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.753 -178.252 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.501 HD13 ' HD2' ' A' ' 83' ' ' PRO . 0.0 OUTLIER -76.93 1.97 16.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.168 -179.33 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.39 -135.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.232 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.76 -17.24 11.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.97 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.953 ' HE2' ' HB2' ' A' ' 122' ' ' LEU . 0.1 OUTLIER -155.88 -20.98 0.11 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.846 HG21 HG13 ' A' ' 115' ' ' VAL . 61.2 mt -50.17 -80.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 CA-C-N 117.706 0.23 . . . . 0.0 111.397 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.074 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.1 -40.22 67.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.557 0.217 . . . . 0.0 110.88 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.95 -28.77 61.22 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.581 176.836 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.645 ' HE3' ' HB1' ' A' ' 118' ' ' ALA . 3.3 ttm -75.65 -37.0 60.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 121.474 0.654 . . . . 0.0 109.83 177.35 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.717 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.06 -9.63 0.66 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.72 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.611 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.24 27.09 8.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.363 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.8 pt-20 -170.19 1.26 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.758 -178.477 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.982 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.99 -148.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 121.436 0.636 . . . . 0.0 111.42 -179.768 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 3.3 t70 -54.38 -9.82 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.799 175.929 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.702 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.6 m120 79.43 -24.1 0.22 Allowed 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.41 -0.813 . . . . 0.0 111.164 -179.696 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -75.51 -28.47 59.15 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.982 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.42 -33.91 63.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.007 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.3 -27.73 68.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.194 178.445 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.602 HD12 HD23 ' A' ' 101' ' ' LEU . 2.7 mp -85.58 -48.33 9.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -39.06 90.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.501 -178.527 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.866 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -57.45 -37.49 72.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.37 -179.365 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.822 HD21 HD13 ' A' ' 70' ' ' LEU . 6.6 mt -87.5 -8.52 56.31 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.115 0.483 . . . . 0.0 110.293 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -106.47 -8.4 17.12 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.267 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.791 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.95 133.48 11.61 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.63 0.252 . . . . 0.0 111.557 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.499 ' O ' HG21 ' A' ' 54' ' ' THR . 51.2 Cg_endo -69.29 3.44 2.54 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.692 2.261 . . . . 0.0 112.207 179.46 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.17 -26.0 3.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.23 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.76 -44.1 94.44 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.223 179.743 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.866 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -47.43 -41.24 19.8 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.471 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 112' ' ' ARG . 1.6 ttt180 -79.09 -64.15 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 t -49.18 -54.07 18.2 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.717 0.294 . . . . 0.0 111.134 -178.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.427 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 5.4 mmtt -59.38 -28.95 67.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.091 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.846 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -71.85 -58.41 5.17 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 178.142 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.433 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.8 t70 -51.24 -36.69 43.09 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.864 0.364 . . . . 0.0 110.869 178.089 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.74 -40.17 69.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.477 179.015 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.645 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.39 -29.82 70.76 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.706 HG21 ' CE1' ' A' ' 82' ' ' HIS . 22.4 t -55.49 -50.62 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-O 121.387 0.613 . . . . 0.0 109.822 177.387 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.51 -29.16 34.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.763 177.442 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.446 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 12.3 t -84.6 -31.65 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.898 179.13 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.953 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.36 -43.17 74.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.958 179.503 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.503 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.3 mm-40 -65.37 -30.33 71.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.887 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.315 179.026 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.671 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.711 0.291 . . . . 0.0 111.121 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.869 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.42 -178.2 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.325 178.026 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.939 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.19 -38.39 39.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.645 -179.134 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.1 -48.91 74.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.843 -179.953 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.561 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -58.13 -40.23 80.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.296 0.569 . . . . 0.0 110.357 179.377 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.939 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.3 mt -64.08 -45.0 90.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.98 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.82 -7.66 29.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.567 178.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.444 ' HB3' ' O ' ' A' ' 57' ' ' MET . 21.5 t -83.77 -5.23 59.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.768 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.353 -179.493 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.606 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.117 0.484 . . . . 0.0 110.297 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.729 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -129.92 40.21 3.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.407 179.3 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.418 ' N ' HD21 ' A' ' 70' ' ' LEU . 52.0 tt0 -138.01 -52.71 0.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.972 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.529 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 3.7 ptt? -81.7 6.52 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -176.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 1.034 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -63.05 -59.08 5.28 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.257 0.551 . . . . 0.0 110.2 -179.82 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.011 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -116.91 32.53 5.44 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.201 -1.0 . . . . 0.0 112.697 -179.183 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -141.09 -1.06 1.4 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.733 0.301 . . . . 0.0 111.27 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.26 -23.04 3.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.092 0.472 . . . . 0.0 110.057 179.343 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.708 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.5 -22.42 54.5 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.663 178.62 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -40.09 -55.26 4.02 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.241 -177.952 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 59.5 Cg_endo -72.4 -16.04 27.8 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.04 1.826 . . . . 0.0 112.596 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.671 HD12 ' HB2' ' A' ' 53' ' ' LEU . 50.6 mt -92.84 -21.1 20.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.603 -179.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.74 HG13 ' HB ' ' A' ' 90' ' ' THR . 10.3 mm -73.15 -38.94 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.743 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 0.2 OUTLIER -52.08 -17.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.04 177.724 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -78.17 -39.38 41.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.864 178.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.689 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -71.42 -45.01 63.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.538 -179.96 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 5.4 m-70 -115.45 139.95 25.28 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.382 -179.979 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -50.5 82.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.53 2.154 . . . . 0.0 112.147 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.743 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 73.5 p 43.72 40.04 2.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.163 -178.837 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -97.17 6.28 48.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.183 -179.477 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -81.07 56.31 2.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.106 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.91 -8.56 75.83 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.151 177.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.634 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.2 tptt -177.65 31.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.394 179.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.882 HG21 HG13 ' A' ' 115' ' ' VAL . 80.9 mt -79.66 -89.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.981 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.011 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -51.66 -42.46 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.448 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.47 -30.65 50.32 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.014 -1.089 . . . . 0.0 110.919 178.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.638 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -83.8 -23.58 31.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.452 -0.374 . . . . 0.0 110.199 178.941 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.57 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.2 mm? -60.72 -10.61 5.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.91 179.052 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.034 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.5 mp -105.68 27.17 8.7 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 176.755 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.638 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -166.03 -0.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.699 -178.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 1.016 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.44 -150.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.508 0.67 . . . . 0.0 111.727 -179.389 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.606 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -55.09 -8.43 0.28 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.851 175.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.764 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 80.08 -31.13 0.13 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.942 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.94 -29.17 68.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.834 178.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 1.016 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -76.08 -34.96 59.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.757 177.255 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.752 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -64.62 -30.15 71.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.913 178.263 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.67 -47.75 11.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.362 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.0 OUTLIER -64.79 -42.2 95.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.494 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.75 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.17 -34.9 66.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.505 -179.123 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.677 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.8 mt -85.84 -11.04 54.39 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.937 -179.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 1.5 pt-20 -109.53 -4.83 15.99 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -143.56 133.52 11.92 Favored Pre-proline 0 C--N 1.331 -0.207 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.948 -179.245 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 54' ' ' THR . 12.8 Cg_exo -70.73 1.13 5.38 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.98 2.453 . . . . 0.0 111.946 179.316 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.551 ' O ' ' HB2' ' A' ' 113' ' ' SER . 76.7 mt-10 -125.56 -11.48 6.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.537 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.04 -44.98 24.88 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.142 0.496 . . . . 0.0 109.733 177.908 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.869 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.77 -41.92 24.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.25 176.07 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.66 -61.14 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.551 -179.499 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.551 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.96 -53.23 20.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.809 0.338 . . . . 0.0 111.224 -178.895 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.68 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 71.4 mmtt -60.59 -29.74 69.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.018 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.882 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.81 -56.01 11.65 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.253 178.774 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.428 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -53.88 -35.36 61.49 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 110.512 178.761 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -38.88 63.29 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.28 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.36 -22.56 66.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.759 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.1 t -68.37 -49.01 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-O 121.084 0.469 . . . . 0.0 109.831 177.022 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.46 -27.17 65.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.389 177.149 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.5 t -83.88 -30.8 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.464 179.097 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -76.07 -33.52 59.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.824 178.804 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -67.54 -33.43 75.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.862 178.442 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.549 177.8 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.816 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.775 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -167.83 179.37 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.372 179.521 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.625 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -46.5 -44.51 17.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.664 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -46.64 82.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.729 179.921 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.509 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.09 -42.36 85.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.898 178.565 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.556 HD22 ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -61.12 -42.23 98.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.417 178.583 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -17.29 48.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.507 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.9 t -69.7 -22.05 63.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.117 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.838 -179.874 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 120.946 0.403 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.558 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -126.85 31.01 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 -179.607 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.516 ' N ' HD21 ' A' ' 70' ' ' LEU . 30.2 tt0 -132.46 -55.93 0.96 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.712 -179.523 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.734 ' HB2' ' HB2' ' A' ' 73' ' ' ARG . 2.8 ptt? -80.9 28.12 0.36 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.563 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -89.87 -47.38 7.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.24 0.543 . . . . 0.0 109.956 178.834 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -110.79 12.62 29.78 Favored Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 177.658 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -127.51 0.53 6.24 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.734 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.49 -31.56 2.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.787 -0.188 . . . . 0.0 111.325 -179.706 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.849 HD22 HD12 ' A' ' 53' ' ' LEU . 2.9 mm? -57.62 -27.15 62.52 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.127 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' CD ' ' A' ' 76' ' ' PRO . 9.2 t80 -38.41 -62.12 0.75 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.003 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.656 ' HG2' HD22 ' A' ' 77' ' ' LEU . 30.0 Cg_endo -62.19 -14.81 40.29 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.897 1.731 . . . . 0.0 112.312 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.656 HD22 ' HG2' ' A' ' 76' ' ' PRO . 2.1 mm? -96.73 -25.99 15.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.866 -178.685 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' A' ' 74' ' ' LEU . 7.3 mm -70.88 -46.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 CA-C-O 120.845 0.355 . . . . 0.0 110.758 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.944 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 21.4 mt-30 -50.11 -19.22 0.7 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.543 178.876 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.61 -37.71 27.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.961 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.5 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.87 -37.27 62.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.757 -179.838 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -124.49 150.62 65.19 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.605 -179.526 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.27 79.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.438 2.092 . . . . 0.0 111.641 179.036 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.944 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 13.1 t 40.35 36.62 0.36 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.368 -178.3 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -86.13 2.63 45.99 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.072 -179.87 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.588 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.75 -141.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.403 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.66 -7.16 59.22 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.816 -179.132 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.656 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.8 OUTLIER -161.98 -25.24 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.748 -0.226 . . . . 0.0 111.527 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.764 HG21 HG13 ' A' ' 115' ' ' VAL . 61.8 mt -49.14 -81.97 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -178.39 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.74 -37.21 70.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.821 -179.828 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.72 -28.33 56.69 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 177.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.583 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.23 -34.67 55.93 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.33 0.586 . . . . 0.0 109.797 177.17 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.726 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -58.27 -9.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.591 -178.264 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.476 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.5 mm? -104.31 26.75 8.51 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.751 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -171.36 1.03 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.031 -178.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.999 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.66 -148.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.466 0.651 . . . . 0.0 111.696 -179.239 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.605 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.6 t0 -54.24 -9.67 0.3 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.863 176.167 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.691 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.7 m120 79.66 -22.07 0.3 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -78.29 -25.33 46.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.058 0.456 . . . . 0.0 109.791 177.407 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.999 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -78.72 -25.44 44.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.817 177.327 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.702 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.9 tp -74.66 -27.24 60.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.094 178.491 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.48 -45.67 9.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.829 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.408 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.7 t-80 -62.85 -47.03 85.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.166 -178.92 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.877 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.1 ptm -52.59 -35.71 54.74 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.536 -178.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.73 HD21 HD13 ' A' ' 70' ' ' LEU . 25.1 mt -83.57 -11.92 56.75 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.963 -178.695 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -108.33 -11.56 15.18 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.715 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.478 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.15 137.05 17.53 Favored Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.981 -178.941 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 6.5 Cg_exo -73.63 2.22 6.07 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.941 2.427 . . . . 0.0 111.923 179.433 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -121.42 -16.01 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.546 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.478 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 3.3 p -74.66 -51.22 14.98 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.007 0.432 . . . . 0.0 109.859 178.612 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.877 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.1 OUTLIER -46.78 -38.77 10.61 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.319 177.429 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.412 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 16.1 ttt180 -81.05 -65.42 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.242 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.411 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 74.9 m -47.63 -54.5 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.785 0.326 . . . . 0.0 111.22 -178.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.428 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 9.0 mmtt -58.89 -33.06 70.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.132 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.764 HG13 HG21 ' A' ' 89' ' ' ILE . 1.3 t -70.61 -55.03 15.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -40.1 60.63 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.89 178.174 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -73.58 -34.9 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.24 178.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 121' ' ' VAL . . . -66.6 -24.15 66.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.961 178.016 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -63.5 -51.46 70.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 176.61 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.6 -24.67 34.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.538 176.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 34.7 t -84.63 -32.83 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.924 179.489 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.656 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.71 -44.23 62.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.023 179.294 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.551 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.0 mm-40 -63.73 -29.5 70.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.986 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.495 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.949 178.276 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.826 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.847 0.356 . . . . 0.0 110.963 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.571 HG21 ' O ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -168.36 -167.16 0.77 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.106 178.658 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 1.079 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.75 -34.5 65.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.51 -178.894 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 75.2 m -65.0 -51.54 61.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.646 179.569 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.658 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.1 -38.23 76.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.278 179.219 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.079 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.2 mt -63.03 -44.64 95.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.575 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.0 -15.99 38.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.96 179.736 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 t -72.76 -5.95 41.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 179.562 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.088 179.891 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.946 0.403 . . . . 0.0 111.146 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.666 ' CA ' HD21 ' A' ' 70' ' ' LEU . 1.8 mttt -136.62 11.16 3.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.291 178.915 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -120.39 -56.55 1.97 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.681 -179.193 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.466 ' HB3' ' HB2' ' A' ' 73' ' ' ARG . 42.8 mtm -60.82 -7.92 2.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -177.572 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.666 HD21 ' CA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -64.73 -48.76 73.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.124 0.488 . . . . 0.0 110.204 -179.124 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.121 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -117.85 14.39 12.76 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.732 178.488 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -128.01 1.58 5.92 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.691 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.53 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.6 tpt180 -126.38 -34.6 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.244 -0.183 . . . . 0.0 110.897 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.758 ' HB3' HD11 ' A' ' 78' ' ' ILE . 3.0 mm? -59.14 -35.25 73.17 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 178.807 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.504 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.0 t80 -35.19 -61.68 0.48 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -174.533 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 33.8 Cg_endo -63.87 -16.86 57.27 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.057 1.838 . . . . 0.0 112.528 -178.972 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.826 HD12 ' HB2' ' A' ' 53' ' ' LEU . 52.4 mt -98.53 -23.95 15.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.799 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.758 HD11 ' HB3' ' A' ' 74' ' ' LEU . 1.6 mm -69.18 -35.78 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-O 120.97 0.414 . . . . 0.0 110.214 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.78 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.1 mt-30 -53.29 -17.32 1.71 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.26 -38.83 20.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.832 178.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.2 -44.85 67.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.126 0.489 . . . . 0.0 110.436 179.549 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -115.75 155.03 48.09 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.227 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.23 75.56 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.47 2.113 . . . . 0.0 111.994 179.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.78 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 30.3 p 47.17 45.85 16.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.213 -179.318 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 2.4 mp -103.39 9.09 38.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.073 -179.636 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -71.39 20.95 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.973 -179.219 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -48.64 -27.35 6.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 178.805 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 92' ' ' MET . 5.0 ttpt -171.9 40.41 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.154 178.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.778 HG21 HG13 ' A' ' 115' ' ' VAL . 47.8 mt -79.84 -83.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.649 178.684 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.121 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.5 -35.9 63.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.418 179.01 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.02 -30.2 60.19 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.219 -1.153 . . . . 0.0 110.219 176.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.586 ' HE1' ' O ' ' A' ' 118' ' ' ALA . 3.2 ttp -75.14 -36.11 61.61 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.031 -0.585 . . . . 0.0 109.882 176.451 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.9 -3.7 0.59 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.582 -177.656 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 101' ' ' LEU . 4.0 mp -109.2 26.16 10.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 175.669 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -170.86 3.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.34 -178.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.82 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.4 -150.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 121.483 0.659 . . . . 0.0 111.619 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.6 t70 -59.58 -2.76 0.38 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.108 177.356 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.634 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.2 m120 77.99 -31.56 0.16 Allowed 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.208 -179.651 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.98 78.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.297 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.82 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.5 mt-10 -68.18 -43.91 77.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.367 177.388 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.731 HD23 HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -54.76 -21.83 12.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.804 0.335 . . . . 0.0 110.711 177.316 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.731 HD12 HD23 ' A' ' 101' ' ' LEU . 2.5 mp -92.92 -45.12 8.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.735 -179.197 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.1 OUTLIER -70.24 -30.25 67.27 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.708 -177.839 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.76 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 0.5 OUTLIER -65.19 -34.51 78.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.632 0.253 . . . . 0.0 110.78 179.846 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.747 HD23 HD13 ' A' ' 58' ' ' LEU . 5.7 mt -87.13 -12.14 47.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.167 0.508 . . . . 0.0 110.052 178.266 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 21.5 mm-40 -105.69 -4.72 20.67 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.083 -176.16 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.909 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.2 t -149.03 133.14 8.76 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.555 -179.415 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.571 ' O ' HG21 ' A' ' 54' ' ' THR . 74.4 Cg_endo -74.55 8.93 2.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.586 2.191 . . . . 0.0 112.358 179.723 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -133.89 -20.51 1.97 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.11 -179.882 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.909 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.2 OUTLIER -64.55 -53.31 49.98 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.208 0.528 . . . . 0.0 109.784 177.73 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 10.0 tt -47.64 -35.36 9.25 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.175 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -86.63 -52.1 5.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.1 m -52.7 -50.13 63.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.663 -178.019 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.76 ' NZ ' ' HB3' ' A' ' 104' ' ' MET . 0.4 OUTLIER -80.4 -25.65 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.946 -178.533 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.778 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -59.9 -51.34 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.594 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.23 -34.42 70.42 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.434 177.467 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -77.18 -27.34 53.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.719 178.331 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.586 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -71.98 -27.74 62.96 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.224 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 16.4 t -58.2 -51.35 72.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.752 176.01 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.53 -28.53 31.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.797 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.52 -31.03 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.99 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.473 HD22 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -69.57 -41.75 75.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.9 179.094 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 82.4 mm-40 -72.49 -24.43 61.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.224 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.189 179.427 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.784 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 110.59 -0.152 . . . . 0.0 110.59 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.81 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -166.86 -176.35 3.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.144 0.497 . . . . 0.0 111.999 179.553 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.08 -56.91 12.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.393 -0.822 . . . . 0.0 112.686 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.2 m -47.37 -34.36 6.89 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.105 0.478 . . . . 0.0 110.97 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.674 ' SD ' ' HA ' ' A' ' 53' ' ' LEU . 4.3 mtt -75.35 -41.54 56.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.447 179.141 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -55.98 -38.09 69.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.822 176.859 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.22 -23.66 62.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.428 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -68.15 -7.39 29.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.29 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.259 -179.742 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.903 0.382 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.611 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.4 28.99 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.966 -179.822 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.429 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -134.08 -52.02 0.84 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.194 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.474 ' HB2' ' CB ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -78.48 15.89 0.92 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -177.175 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.43 -31.72 17.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.115 0.483 . . . . 0.0 110.591 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.024 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.36 10.39 5.31 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.552 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -127.92 -6.17 5.59 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.583 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -126.54 -16.51 5.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.935 0.397 . . . . 0.0 110.565 179.354 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.784 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.72 -16.75 58.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.059 178.964 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.725 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 13.8 t80 -49.34 -53.88 35.48 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.924 -177.543 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.1 Cg_exo -65.73 -6.45 14.0 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.149 1.9 . . . . 0.0 112.494 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.608 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.78 -38.68 8.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.635 -179.274 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.783 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.8 mm -60.0 -40.47 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.883 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.904 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 31.0 mt-30 -47.66 -21.45 0.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.796 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.11 -44.03 17.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.848 178.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -66.78 -43.14 84.75 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.302 0.572 . . . . 0.0 110.225 179.187 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.871 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.7 m170 -121.52 143.99 39.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.456 -177.729 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.53 80.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.563 2.175 . . . . 0.0 112.254 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.904 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 61.9 p 43.32 32.72 0.51 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.196 -179.115 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -88.34 6.93 34.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.09 -179.367 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.783 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.59 20.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.882 -179.422 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -54.26 -22.62 22.88 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.834 -179.933 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.0 OUTLIER -165.46 28.76 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.0 111.216 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.866 HG21 HG13 ' A' ' 115' ' ' VAL . 60.8 mt -80.42 -88.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.386 -0.525 . . . . 0.0 110.817 179.019 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.024 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.02 -41.5 59.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.279 -179.943 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.67 -31.13 57.48 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.068 -1.063 . . . . 0.0 111.055 178.497 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.63 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.43 -23.29 32.37 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 178.685 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.628 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.63 -7.53 3.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.631 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.666 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.6 mp -106.66 26.26 10.2 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.7 pt-20 -167.08 1.87 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.33 -178.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.948 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -151.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 121.334 0.587 . . . . 0.0 111.697 -179.702 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 0.8 OUTLIER -59.04 -3.56 0.37 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.998 177.949 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 34.3 m-80 79.19 -28.65 0.15 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.524 179.536 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -31.22 60.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.09 0.471 . . . . 0.0 109.877 178.201 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.948 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -75.42 -23.32 56.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.937 177.863 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -75.1 -25.62 58.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.862 177.031 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mp -87.15 -49.38 7.33 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.984 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.49 -46.97 87.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.709 -179.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.924 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -53.2 -36.51 61.05 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -178.169 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' HD23 ' A' ' 58' ' ' LEU . 6.9 mt -86.64 -5.5 59.11 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.342 0.592 . . . . 0.0 110.071 179.1 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -110.44 -8.09 14.71 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.001 -175.026 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.476 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.4 OUTLIER -146.25 142.0 17.09 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.061 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.507 ' O ' HG21 ' A' ' 54' ' ' THR . 7.5 Cg_exo -73.2 -0.57 9.34 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 179.437 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -124.43 -19.38 5.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.568 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 4.4 p -63.74 -50.53 68.71 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.233 0.54 . . . . 0.0 109.79 178.169 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.924 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -46.49 -29.24 1.67 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.118 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.59 -63.42 1.23 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.985 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 43.5 m -49.31 -30.21 7.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.958 179.15 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.0 mmtm -80.84 -41.22 23.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.844 178.093 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.866 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -66.43 -62.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.124 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t0 -48.67 -36.13 15.37 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.644 0.259 . . . . 0.0 111.258 178.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 113' ' ' SER . 7.4 mt-10 -74.05 -41.14 62.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.818 0.342 . . . . 0.0 110.514 179.114 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.44 -21.77 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.691 178.057 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.871 HG21 ' CE1' ' A' ' 82' ' ' HIS . 59.1 t -66.79 -46.43 85.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.866 177.412 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.16 -26.57 66.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.506 176.652 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 11.2 t -85.32 -32.08 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.579 179.057 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.503 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.79 -35.77 70.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.825 179.004 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -71.97 -28.52 63.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.114 178.33 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.235 179.234 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.825 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.845 0.355 . . . . 0.0 110.95 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.904 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -163.62 -171.95 2.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.489 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.73 -36.88 62.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.192 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.95 -46.01 92.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.064 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.825 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.66 -43.22 89.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.056 178.325 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.532 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -57.77 -48.23 80.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.572 178.973 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.37 -3.21 19.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.367 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 t -87.23 -6.77 58.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.074 -179.787 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.283 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.675 -179.954 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.953 0.406 . . . . 0.0 110.648 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.651 ' HA ' HD21 ' A' ' 70' ' ' LEU . 5.4 ptpt -116.18 40.65 2.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.888 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -139.23 -54.54 0.58 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.721 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.614 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -81.08 3.07 24.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.849 -178.889 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.816 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -69.97 -39.33 76.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 0.0 111.085 179.765 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.082 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.34 24.96 3.34 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.236 -0.983 . . . . 0.0 112.87 -179.504 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -138.09 -5.42 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.582 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.28 -20.85 4.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.873 -179.825 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.744 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -74.83 -13.09 60.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.692 -178.748 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.719 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 8.4 t80 -48.32 -56.71 13.06 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.703 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.719 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 24.5 Cg_exo -63.29 -11.7 26.77 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.042 1.828 . . . . 0.0 112.046 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.1 mm? -94.79 -28.35 15.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.462 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.763 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -67.78 -39.64 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.013 -179.608 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.881 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -50.47 -20.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 110.125 178.682 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.75 -40.87 24.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.449 179.668 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.763 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.44 -50.75 28.7 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.184 0.516 . . . . 0.0 110.52 -179.62 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.784 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -111.49 151.61 43.39 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.491 -179.673 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.612 ' HG2' HD23 ' A' ' 85' ' ' LEU . 18.8 Cg_endo -59.53 81.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.387 2.058 . . . . 0.0 111.798 179.555 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.881 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.0 t 42.13 31.0 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.532 -178.776 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.654 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -80.45 2.22 26.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.01 -144.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.971 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.72 -15.62 50.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.69 -179.114 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.833 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.1 tptt -156.46 -22.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.953 HG21 HG13 ' A' ' 115' ' ' VAL . 68.4 mt -49.25 -86.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -177.491 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.082 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.97 -41.83 64.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.276 -178.599 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.27 -31.45 50.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.217 178.463 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.833 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.79 -25.06 30.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.885 0.374 . . . . 0.0 110.323 179.185 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.616 HD12 ' HE3' ' A' ' 104' ' ' MET . 4.1 mm? -59.08 -10.86 2.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.417 178.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.816 HD21 HD13 ' A' ' 70' ' ' LEU . 3.8 mp -101.89 25.97 8.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.728 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -169.1 1.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.154 -177.614 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.42 -148.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.41 0.624 . . . . 0.0 111.408 -179.417 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.616 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.2 t70 -54.33 -9.42 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.824 176.081 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.719 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 79.88 -23.1 0.25 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.138 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -32.74 58.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.408 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -69.65 -34.64 74.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.049 177.545 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.668 HD21 HD22 ' A' ' 70' ' ' LEU . 2.3 tm? -65.9 -28.73 69.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.274 178.741 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.15 -49.85 9.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.911 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.509 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 1.5 t-80 -58.79 -48.44 81.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.958 -178.888 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.801 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.9 OUTLIER -52.29 -35.5 50.56 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.157 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 101' ' ' LEU . 17.5 mt -84.8 -8.78 58.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 0.0 110.791 -179.404 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.06 -7.33 16.14 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.615 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.467 ' HB3' ' H ' ' A' ' 110' ' ' SER . 0.5 OUTLIER -143.13 140.15 17.53 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 120.506 -0.477 . . . . 0.0 112.042 -179.169 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.563 ' O ' HG21 ' A' ' 54' ' ' THR . 60.1 Cg_endo -72.18 3.8 3.77 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.645 2.23 . . . . 0.0 111.991 179.07 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -128.72 -19.01 3.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.467 ' H ' ' HB3' ' A' ' 107' ' ' SER . 4.9 p -64.22 -49.86 70.29 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.356 0.598 . . . . 0.0 109.675 177.447 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.904 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.95 -26.78 1.07 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.783 178.05 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -95.94 -65.69 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.78 179.311 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 5.0 m -46.12 -30.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.296 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.786 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 69.4 mmtt -80.44 -42.44 22.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.697 177.819 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.953 HG13 HG21 ' A' ' 89' ' ' ILE . 2.2 t -66.06 -60.37 2.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.874 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.404 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t70 -48.0 -38.9 18.14 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.31 178.679 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 113' ' ' SER . 1.9 mt-10 -76.87 -33.27 57.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.271 179.466 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.751 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.55 -26.79 66.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.882 177.958 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.784 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.0 t -61.52 -51.14 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.05 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.58 32.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.779 177.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 14.3 t -85.52 -31.35 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.945 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.701 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.53 -41.31 63.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.026 179.363 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.43 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 2.2 mm-40 -61.69 -37.96 86.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 178.822 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.352 177.072 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.735 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.78 0.324 . . . . 0.0 110.736 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.886 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.11 -176.44 2.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.294 179.099 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.972 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.23 -25.06 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 111.269 -179.488 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.449 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 40.6 m -74.23 -49.13 24.65 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.741 179.562 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.735 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.11 -39.45 78.69 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.376 0.608 . . . . 0.0 109.997 178.776 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.972 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.3 mt -64.1 -45.04 90.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.418 179.102 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.79 -7.85 18.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.844 179.066 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.4 t -84.05 -7.3 59.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.616 179.317 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.319 179.819 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.051 0.453 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.456 ' C ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -107.85 36.72 2.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.473 178.471 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 1.3 tp-100 -127.6 -52.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.483 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 14.4 mtm -76.03 -6.17 49.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.659 -179.378 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.82 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -63.2 -32.45 73.85 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.172 -179.421 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 1.036 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -148.74 27.48 1.31 Allowed Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.822 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 3.3 mt-10 -142.29 0.39 1.33 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.891 0.377 . . . . 0.0 111.173 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -136.12 -20.84 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.169 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.647 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -73.48 -22.7 60.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.353 178.283 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.538 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -39.82 -56.04 3.34 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.355 -177.906 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 11.6 Cg_exo -73.1 -15.74 25.69 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.326 2.017 . . . . 0.0 112.784 -179.255 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.68 HD12 ' HB2' ' A' ' 53' ' ' LEU . 37.1 mt -91.23 -32.01 15.93 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.624 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 74' ' ' LEU . 2.5 mm -65.19 -37.13 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.089 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.768 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.0 mt-30 -48.92 -16.16 0.12 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.495 177.14 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.429 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -84.27 -44.58 13.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.675 178.186 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.427 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 1.2 mtm -67.67 -27.81 67.16 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.563 0.697 . . . . 0.0 110.18 178.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.616 ' CD2' HD11 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -114.29 164.2 16.97 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.739 -177.257 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.498 ' HD2' ' CG ' ' A' ' 82' ' ' HIS . 74.0 Cg_endo -77.11 47.68 2.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.134 1.889 . . . . 0.0 111.368 177.021 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.768 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 66.45 51.05 1.2 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.796 -178.487 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HB3' ' CD2' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -118.94 0.81 11.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.719 179.789 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.556 ' CB ' ' HB ' ' A' ' 78' ' ' ILE . . . -73.46 58.63 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.179 179.455 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -98.24 -0.7 58.3 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.885 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.5 ttpt -156.74 -15.79 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.023 -0.588 . . . . 0.0 111.908 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.958 HG21 HG13 ' A' ' 115' ' ' VAL . 48.5 mt -51.18 -84.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -176.812 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 1.036 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -51.46 -38.37 53.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.02 -177.851 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.95 -29.87 68.77 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.99 -1.1 . . . . 0.0 110.367 176.262 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.885 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.4 ttm -75.56 -37.75 59.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.042 176.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.577 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.6 mm? -55.61 -8.34 0.37 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.48 -178.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.82 HD11 HD13 ' A' ' 70' ' ' LEU . 4.9 mp -106.26 27.94 8.2 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.688 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.407 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -171.98 3.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.462 -178.252 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.934 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.22 -151.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.318 0.58 . . . . 0.0 111.496 -179.86 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.509 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.8 t0 -59.53 -3.54 0.48 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.237 178.253 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.594 ' H ' HG12 ' A' ' 96' ' ' ILE . 27.4 m120 77.82 -27.23 0.17 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.425 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -77.75 -23.35 49.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 177.785 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.934 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.92 -25.87 29.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.676 177.512 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -74.99 -24.75 58.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.393 0.615 . . . . 0.0 109.385 176.134 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -86.73 -48.6 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.074 -0.967 . . . . 0.0 111.158 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.446 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.04 -37.28 83.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.194 -178.695 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.825 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -57.56 -36.82 72.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.136 -179.85 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.714 HD23 HD13 ' A' ' 58' ' ' LEU . 6.9 mt -87.11 -9.77 54.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.211 0.529 . . . . 0.0 110.047 178.445 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 62.8 mm-40 -108.44 -1.98 19.4 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.28 -176.144 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.845 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -150.32 135.95 10.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.764 -179.462 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.528 ' O ' HG21 ' A' ' 54' ' ' THR . 72.5 Cg_endo -74.04 3.98 4.63 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.566 2.177 . . . . 0.0 112.04 179.025 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 113' ' ' SER . 7.7 mt-10 -128.0 -11.41 5.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.607 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.845 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.83 -44.68 22.48 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.606 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.886 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.28 -40.82 17.67 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.95 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -81.16 -64.39 1.2 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.28 179.38 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.01 -51.13 25.24 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 -178.702 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.814 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 30.9 mmtt -61.01 -30.18 70.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.845 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.958 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -72.83 -55.0 14.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.62 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 0.5 OUTLIER -56.9 -28.65 62.2 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.227 0.537 . . . . 0.0 109.927 177.314 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -80.02 -33.93 38.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.383 177.223 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.736 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.67 -17.87 64.17 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.514 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.62 ' HB ' ' O ' ' A' ' 116' ' ' ASP . 37.1 t -66.77 -52.79 41.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.412 175.864 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.06 -27.49 61.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.968 177.389 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 15.2 t -85.94 -31.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.691 179.123 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -74.14 -29.35 61.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.348 -179.733 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -83.2 -23.59 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.786 177.28 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.054 179.32 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.34 -63.31 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.603 2.202 . . . . 0.0 112.166 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 mt -89.95 -173.13 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.71 56.97 0.67 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.575 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.6 t -104.12 -61.53 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.731 0.301 . . . . 0.0 110.929 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -109.87 -172.18 1.99 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.042 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.34 102.84 2.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -139.75 -25.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 55.37 72.63 0.47 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.159 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.83 117.91 5.09 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.975 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.34 -4.94 15.95 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.451 2.101 . . . . 0.0 112.341 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.16 74.63 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.005 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.4 t -89.7 23.55 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.1 ttt85 -97.6 -52.49 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 p -97.4 163.7 12.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.004 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 11.2 m -88.72 147.62 39.75 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.071 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.75 147.49 40.48 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.58 2.186 . . . . 0.0 112.387 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -74.29 84.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.862 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -73.78 -14.77 61.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 mptt -96.7 88.32 4.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -78.15 92.83 4.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.23 104.02 9.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.251 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.1 135.86 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.958 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -92.11 48.32 2.69 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.583 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 t -90.67 -20.39 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.971 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.6 mtt180 -79.11 171.92 14.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -85.86 113.43 51.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.869 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.97 88.73 1.06 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.452 2.101 . . . . 0.0 112.397 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -78.9 -174.37 3.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.8 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -98.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.826 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.7 m170 51.59 31.14 7.3 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.879 0.371 . . . . 0.0 111.138 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.55 41.7 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.995 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -101.73 8.93 41.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -91.9 71.16 5.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.079 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.568 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 1.0 OUTLIER -96.16 -51.49 0.23 Allowed Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.361 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 25.4 Cg_exo -63.59 -174.0 0.2 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.321 2.014 . . . . 0.0 112.185 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.17 128.56 33.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.813 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 p -86.24 124.28 40.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.023 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.9 t -106.64 -0.99 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.866 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.534 ' O ' ' HG2' ' A' ' 42' ' ' GLN . 0.8 OUTLIER -89.63 177.54 6.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 62.42 20.67 12.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.06 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 40' ' ' MET . 7.5 pt20 -156.9 96.2 2.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.948 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.25 171.64 1.68 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.614 2.209 . . . . 0.0 112.224 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -84.72 57.17 4.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.944 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -104.81 93.15 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.146 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -84.25 179.44 7.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 p -96.63 98.92 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.1 0.476 . . . . 0.0 110.991 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -98.37 -31.76 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.871 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.81 -165.11 34.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.556 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -99.07 -178.51 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.692 0.282 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' H ' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -63.79 129.27 93.7 Favored Pre-proline 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.038 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.46 179.03 6.81 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.465 2.11 . . . . 0.0 112.415 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.679 HD12 ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -92.79 138.61 31.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.838 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.689 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -173.98 -163.76 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.514 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.666 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.29 -43.8 88.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.506 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.446 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 31.9 m -56.56 -45.39 81.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.844 0.354 . . . . 0.0 110.487 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.43 -40.43 94.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.666 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -60.98 -45.38 95.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -9.1 52.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.08 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.0 t -82.41 -8.73 59.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.591 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.73 57.7 27.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.169 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.652 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 52.7 Cg_exo -54.6 -51.53 10.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.392 2.062 . . . . 0.0 113.127 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 61.7 Cg_endo -94.37 15.69 1.18 Allowed 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.424 2.083 . . . . 0.0 112.5 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.458 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 1.9 mt-30 -124.7 -98.84 0.42 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.559 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.762 ' HB2' ' HG3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.07 47.39 0.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.492 -178.075 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.652 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -68.24 -24.73 64.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.053 0.454 . . . . 0.0 110.772 179.23 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.577 ' CA ' HD21 ' A' ' 70' ' ' LEU . 4.7 mmtt -124.79 35.17 4.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.577 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.724 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 5.9 tt0 -130.42 -61.97 0.94 Allowed 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.762 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 35.9 mtm -58.82 -9.38 1.76 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.712 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -70.12 -28.31 65.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.961 0.41 . . . . 0.0 110.81 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.046 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -146.52 9.92 1.45 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.442 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.28 -9.62 6.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.538 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.16 -12.73 5.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.909 0.385 . . . . 0.0 110.531 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.679 ' HG ' HD12 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.59 -17.1 58.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.928 -179.313 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.704 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.7 t80 -47.12 -54.57 19.93 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 22.1 Cg_exo -65.37 -9.25 21.48 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.134 1.889 . . . . 0.0 112.249 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.3 mm? -96.3 -39.06 9.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.794 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.675 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.0 mm -60.34 -41.61 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.859 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.674 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.4 mt-30 -48.53 -20.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.627 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.72 -43.67 16.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.856 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.466 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -67.78 -40.85 83.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.5 179.604 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.846 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.9 m170 -123.18 144.1 42.65 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.55 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -55.75 81.57 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.478 2.119 . . . . 0.0 111.715 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.674 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 9.4 t 41.42 30.3 0.13 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.276 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.56 0.4 34.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.675 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.67 -138.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.621 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.88 -8.56 49.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.856 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.573 ' HE2' ' SD ' ' A' ' 92' ' ' MET . 1.2 tptt -161.3 -25.6 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.738 -0.231 . . . . 0.0 111.501 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.81 HG21 HG13 ' A' ' 115' ' ' VAL . 61.0 mt -49.2 -80.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.046 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.63 -38.51 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.684 -0.235 . . . . 0.0 110.937 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.79 -28.7 57.55 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.573 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.39 -34.34 54.9 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.199 0.523 . . . . 0.0 109.827 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.949 ' HB3' ' HE3' ' A' ' 104' ' ' MET . 4.5 mm? -58.76 -7.97 1.17 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.691 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.694 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.4 mp -107.84 27.83 8.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.404 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.9 pt-20 -171.59 3.24 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.521 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.964 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.332 0.587 . . . . 0.0 111.85 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.42 -2.46 0.32 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.361 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 9.6 m-20 78.27 -30.12 0.16 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.42 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.87 -31.88 65.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.074 0.464 . . . . 0.0 109.83 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.964 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.9 OUTLIER -76.37 -23.3 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.775 177.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.629 ' HB2' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -75.27 -23.75 57.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.049 177.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.524 HD12 HD23 ' A' ' 101' ' ' LEU . 3.7 mp -91.07 -45.67 8.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.3 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.408 ' HD2' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.32 -39.6 92.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.056 -179.049 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.949 ' HE3' ' HB3' ' A' ' 93' ' ' LEU . 0.1 OUTLIER -59.98 -33.13 71.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.491 -179.56 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.712 HD21 HD13 ' A' ' 70' ' ' LEU . 17.3 mt -85.37 -12.35 52.37 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.742 0.306 . . . . 0.0 110.946 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.408 ' HG2' ' HD2' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -105.83 -8.62 17.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.783 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -142.89 132.54 11.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.87 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 13.8 Cg_exo -69.88 1.62 4.35 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.893 2.395 . . . . 0.0 111.913 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -120.37 -26.56 5.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.272 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.93 -45.24 90.13 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.689 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -57.19 -26.28 60.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.062 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -88.28 -46.58 9.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.256 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 t -69.3 -33.53 73.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.874 0.369 . . . . 0.0 110.713 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.681 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 6.8 mmtt -78.85 -27.81 44.2 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.185 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.81 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -72.39 -55.88 11.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.298 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.467 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 20.2 t0 -52.91 -39.01 62.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 177.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -39.66 75.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.423 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.81 -22.07 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.043 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.846 HG21 ' CE1' ' A' ' 82' ' ' HIS . 56.1 t -65.3 -44.77 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.938 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.14 -25.93 65.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.505 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.2 t -86.92 -31.39 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.857 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -71.98 -40.53 68.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.992 179.178 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' A' ' 128' ' ' LYS . 81.1 mm-40 -68.48 -32.01 71.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.159 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.471 ' HA ' ' HG3' ' A' ' 128' ' ' LYS . . . -78.71 -10.99 59.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.923 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.832 ' HA ' ' HB3' ' A' ' 130' ' ' ALA . 1.6 t60 -117.52 -0.1 11.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.105 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -81.69 -95.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.413 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.24 21.88 7.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.698 0.285 . . . . 0.0 111.767 -178.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.471 ' HG3' ' HA ' ' A' ' 124' ' ' ALA . 12.6 mttt -88.47 -154.41 0.28 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 111.081 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.48 -0.67 56.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.151 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.832 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . . . -87.4 20.66 2.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.064 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.16 124.59 20.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.069 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -87.93 138.45 31.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.9 -26.67 21.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.57 109.04 4.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.0 m -104.04 -0.78 10.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -90.0 -14.25 34.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.893 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 84.6 p -84.32 -5.82 59.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.857 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.22 -174.74 5.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 16.9 p -93.52 154.61 17.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.937 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 142' ' ' PRO . . . -100.5 -84.9 1.83 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.48 106.75 34.82 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.461 0.172 . . . . 0.0 111.126 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 140' ' ' GLY . 53.0 Cg_exo -55.44 125.52 19.41 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.636 2.224 . . . . 0.0 112.351 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 55.7 p -83.83 172.6 12.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.821 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.0 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 CA-C-O 119.993 -0.337 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -72.29 -45.74 0.43 Allowed 'Cis proline' 0 C--N 1.347 0.479 0 C-N-CA 123.765 -1.348 . . . . 0.0 112.414 0.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.86 140.35 30.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.024 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.27 90.58 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.615 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.8 t -93.26 52.55 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.351 . . . . 0.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.57 158.0 0.09 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.271 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -165.15 25.55 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.129 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 59.22 -92.49 0.04 OUTLIER 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.141 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -117.27 -95.24 0.48 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.03 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -170.41 79.59 0.59 Allowed Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.02 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -82.07 39.5 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.652 2.235 . . . . 0.0 112.348 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.48 96.97 8.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.16 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.76 85.49 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -70.58 136.76 49.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.957 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.79 126.22 35.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -109.37 136.44 20.2 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.37 121.15 8.38 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.475 2.116 . . . . 0.0 112.262 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -79.54 93.81 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.81 119.13 12.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.922 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.89 41.39 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -88.57 16.84 6.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.862 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.67 -169.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.001 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.18 53.92 2.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.999 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.0 67.91 3.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.483 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -12.11 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.791 0.329 . . . . 0.0 111.043 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -15.87 49.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.905 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.406 ' HA ' ' C ' ' A' ' 28' ' ' PRO . 2.8 t30 -97.07 139.9 21.77 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 27' ' ' ASN . 11.5 Cg_exo -71.75 153.84 97.42 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.762 -1.349 . . . . 0.0 112.25 0.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -93.54 -79.19 0.41 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.997 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -100.17 109.14 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.015 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -101.22 9.89 41.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.766 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.435 HD22 HD22 ' A' ' 33' ' ' ASN . 1.3 tt -97.69 -74.56 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.435 HD22 HD22 ' A' ' 32' ' ' LEU . 0.7 OUTLIER -105.41 53.85 0.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 -179.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 30' ' ' GLN . . . -74.08 -168.07 0.58 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.017 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -106.23 96.27 13.07 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.953 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.35 -9.8 25.94 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.431 2.087 . . . . 0.0 112.343 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -96.48 91.24 5.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.019 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.5 m -88.45 2.12 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.1 24.14 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.846 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.08 -169.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.004 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -75.59 -158.79 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.858 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -121.52 80.63 38.79 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.071 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -69.87 86.42 0.6 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.426 2.084 . . . . 0.0 112.177 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -86.34 43.17 1.04 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.196 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.8 m -90.73 4.4 6.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.097 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -98.07 15.78 23.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.024 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 13.7 p -95.09 144.94 8.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.113 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -83.3 156.81 22.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.808 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -80.52 103.37 2.18 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.781 -0.724 . . . . 0.0 112.463 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -106.51 92.41 4.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -86.06 114.93 59.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.96 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.72 166.84 17.15 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.561 2.174 . . . . 0.0 112.524 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.71 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -91.22 150.12 21.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.67 179.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.731 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.58 -167.44 0.78 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.433 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 1.03 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.57 -43.97 65.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.852 -178.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -57.72 -51.23 70.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.874 0.369 . . . . 0.0 110.747 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.514 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.19 -38.59 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.248 179.166 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.03 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.0 mt -63.96 -42.89 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.064 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.18 -15.59 60.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.058 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.6 m -73.86 -6.98 50.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.884 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.64 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.24 61.85 57.4 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.039 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.588 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 45.1 Cg_exo -56.03 -53.07 5.98 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.577 2.185 . . . . 0.0 113.248 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.4 Cg_endo -98.27 24.03 0.24 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.529 2.153 . . . . 0.0 112.674 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.64 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -129.35 -94.88 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.75 -178.659 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.689 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.21 37.07 2.47 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -177.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.588 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.49 -23.61 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.918 0.39 . . . . 0.0 110.825 179.336 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.576 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -129.75 28.65 5.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.841 179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.51 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.37 -54.98 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.965 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.689 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -75.52 18.1 0.25 Allowed 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -177.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.729 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -89.42 -32.58 17.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.239 0.542 . . . . 0.0 110.445 179.619 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.125 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.15 11.6 4.74 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.037 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.471 ' HG2' ' HG3' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -129.26 -8.54 4.75 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.145 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -127.34 -14.17 5.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.774 0.321 . . . . 0.0 110.969 179.852 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.631 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.31 -10.99 59.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.708 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 11.5 t80 -49.01 -55.41 20.78 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.68 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.6 Cg_exo -62.34 -9.73 16.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.087 1.858 . . . . 0.0 112.157 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.71 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.5 mm? -98.81 -28.21 13.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.579 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.75 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.8 mm -70.6 -40.47 77.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.732 0.301 . . . . 0.0 111.244 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.778 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.7 mt-30 -52.62 -19.3 2.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.351 0.596 . . . . 0.0 110.103 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.26 -38.88 30.04 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.959 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.75 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.2 -48.63 33.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.24 0.543 . . . . 0.0 110.167 179.413 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.848 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.5 m-70 -111.97 146.18 34.26 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.467 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.587 ' HD2' HD12 ' A' ' 85' ' ' LEU . 36.6 Cg_exo -57.18 78.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.544 2.163 . . . . 0.0 112.014 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.778 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 48.17 37.17 7.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.062 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.848 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.3 OUTLIER -92.48 4.99 52.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -179.351 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.635 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.88 -138.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.948 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.85 -10.14 53.38 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.793 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.647 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.1 tptt -159.96 -23.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.694 -0.253 . . . . 0.0 111.536 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.844 HG21 HG13 ' A' ' 115' ' ' VAL . 69.2 mt -49.68 -81.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.125 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -55.95 -37.72 69.39 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.636 0.255 . . . . 0.0 110.672 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.63 -28.45 59.93 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.218 -0.991 . . . . 0.0 110.648 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.8 ttp -76.91 -33.99 57.74 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.352 0.596 . . . . 0.0 109.718 177.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.71 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -60.23 -4.61 0.85 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.829 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.651 HD13 ' HA3' ' A' ' 71' ' ' GLY . 3.4 mp -110.04 25.88 11.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 176.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -168.04 1.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.358 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.92 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.21 -153.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.439 0.638 . . . . 0.0 111.955 -179.531 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -59.82 -2.62 0.41 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.302 178.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.591 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 79.49 -36.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.163 -179.466 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 3.0 m -65.28 -27.35 68.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.847 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.92 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -82.99 -25.62 32.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.587 177.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.678 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 2.3 tp -75.14 -25.33 58.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.701 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.75 -48.02 7.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.323 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.461 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -65.27 -37.01 85.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.429 -178.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.71 ' HE1' ' HB3' ' A' ' 93' ' ' LEU . 8.2 ptm -60.09 -38.17 82.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.797 0.332 . . . . 0.0 111.083 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.825 HD23 HD13 ' A' ' 58' ' ' LEU . 40.2 mt -81.64 -11.43 59.1 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.953 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -109.48 -9.11 14.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.857 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.836 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -140.77 126.95 11.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.661 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 17.1 Cg_exo -68.07 6.72 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.876 2.384 . . . . 0.0 112.314 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 107' ' ' SER . 2.1 tt0 -127.8 -26.43 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.1 -46.78 85.72 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.7 tt -49.99 -23.71 2.18 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.779 178.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 112' ' ' ARG . 15.1 mtp180 -92.96 -62.96 1.28 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.2 t -50.05 -29.54 9.03 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.126 0.489 . . . . 0.0 109.791 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.667 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -81.0 -42.98 20.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.666 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.844 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -63.97 -58.15 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -50.98 -42.72 60.36 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.734 0.302 . . . . 0.0 110.868 178.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 113' ' ' SER . 4.4 mt-10 -70.31 -32.46 70.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.327 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.01 -24.74 64.25 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.113 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.721 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -63.38 -46.11 96.27 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 CA-C-O 121.291 0.567 . . . . 0.0 109.664 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.44 -26.27 63.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.742 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 7.9 t -86.98 -32.63 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.741 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.61 -38.29 77.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.93 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.452 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 14.6 mm100 -74.16 -27.0 60.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.962 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.984 ' HB1' ' HB3' ' A' ' 130' ' ' ALA . . . -83.54 -2.4 55.91 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.073 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.431 ' CG ' ' HB3' ' A' ' 131' ' ' ALA . 2.3 t-160 -121.59 -26.14 4.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.044 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -83.75 -38.54 21.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.019 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.596 ' HB3' ' HD2' ' A' ' 128' ' ' LYS . . . -95.5 -62.85 1.23 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.758 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.733 ' H ' ' HD2' ' A' ' 128' ' ' LYS . 0.0 OUTLIER -98.14 169.06 9.87 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.852 0.834 . . . . 0.0 111.282 179.23 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.11 22.47 3.73 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.575 173.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.984 ' HB3' ' HB1' ' A' ' 124' ' ' ALA . . . -57.03 -37.66 72.05 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.586 -175.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.431 ' HB3' ' CG ' ' A' ' 125' ' ' HIS . . . -79.81 101.13 8.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.006 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -91.17 164.88 13.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -10.45 59.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.882 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -76.78 126.68 31.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.12 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 17.6 m -95.31 15.27 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.165 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -79.9 -40.13 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.948 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.81 -7.55 54.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.963 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -79.65 74.35 6.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.032 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 15.2 p -115.78 -173.82 2.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -86.9 -71.18 1.3 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.549 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 9.9 m -94.94 147.4 33.01 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.592 0.234 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -64.87 140.31 66.22 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.439 2.093 . . . . 0.0 112.294 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.534 HG23 ' H ' ' A' ' 144' ' ' VAL . 0.0 OUTLIER -104.67 -63.65 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.014 -179.814 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.534 ' H ' HG23 ' A' ' 143' ' ' THR . 3.9 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.154 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 112.551 -0.22 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.62 175.62 6.88 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.465 2.11 . . . . 0.0 112.381 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 mp -80.65 -9.36 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -99.44 127.0 9.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.509 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.47 173.21 7.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.856 0.36 . . . . 0.0 110.907 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.28 -0.73 29.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.133 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.31 20.87 16.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.969 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.79 -28.19 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -137.42 91.21 2.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.091 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.14 118.88 59.37 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.52 4.02 4.85 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.606 2.204 . . . . 0.0 112.455 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.57 67.0 9.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.138 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.3 t -77.73 -31.73 17.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.951 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -77.46 174.76 10.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.75 55.89 3.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.2 100.99 49.17 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.59 -176.43 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.494 2.129 . . . . 0.0 112.275 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -165.91 0.59 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.96 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.39 145.75 55.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -98.01 108.49 21.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.926 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -0.82 33.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.91 139.12 56.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.027 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.52 -29.15 24.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.068 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.19 88.5 0.73 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 13.7 p -95.82 -28.58 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.887 0.375 . . . . 0.0 110.988 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -88.9 104.09 16.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.542 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 2.1 m-20 -86.94 -51.07 0.44 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.579 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 27' ' ' ASN . 38.2 Cg_endo -66.03 103.63 0.64 Allowed 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.037 1.825 . . . . 0.0 112.236 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -177.15 3.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -79.13 -26.23 42.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 57.32 26.94 13.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.061 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 tp -95.48 119.51 34.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -105.01 81.13 1.7 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.87 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.14 177.32 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -93.66 128.58 41.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.997 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.59 92.42 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.536 2.157 . . . . 0.0 112.352 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.09 108.67 19.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.0 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.9 p -91.05 140.9 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.938 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.35 74.1 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.04 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -30.6 22.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.842 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.55 83.3 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.08 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -80.56 110.14 15.79 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.68 175.08 11.75 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.0 112.5 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.8 173.92 12.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.936 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.4 ' H ' HG22 ' A' ' 45' ' ' VAL . 3.5 m -76.4 -172.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.039 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.58 82.42 2.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 m -111.31 56.11 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.027 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -74.45 -34.02 63.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.802 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.55 -76.0 1.25 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.373 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -84.69 75.2 10.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.853 0.359 . . . . 0.0 110.733 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.561 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 6.3 mt-10 -70.04 -51.49 14.37 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.446 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 85.7 Cg_endo -82.99 125.63 4.18 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.257 1.971 . . . . 0.0 112.706 -179.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.764 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -83.39 151.55 25.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.535 179.12 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.889 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -170.21 -159.37 0.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.751 179.501 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -60.69 -37.31 81.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.313 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.3 m -59.8 -46.46 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.349 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.92 -40.65 94.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.191 178.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.626 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.31 -47.19 84.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.561 179.214 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.94 -12.68 61.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.217 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' A' ' 57' ' ' MET . 46.3 t -76.39 -7.36 54.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.726 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -134.4 60.49 43.65 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.185 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.559 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.8 Cg_exo -55.05 -51.29 10.6 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.534 2.156 . . . . 0.0 113.284 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 79.3 Cg_endo -89.04 -23.42 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.245 1.963 . . . . 0.0 112.622 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.726 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 43.3 tt0 -78.68 -91.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.843 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -95.24 -90.08 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.916 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.463 ' H ' ' HB2' ' A' ' 65' ' ' GLU . 0.4 OUTLIER 73.53 -40.92 0.48 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.379 0.425 . . . . 0.0 110.937 -179.201 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.54 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.8 mtpt -124.83 18.16 8.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.358 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.843 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -114.75 -43.57 3.13 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.396 -179.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.476 ' HG3' ' CB ' ' A' ' 65' ' ' GLU . 30.4 mtm -77.22 -9.63 58.91 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -39.61 80.49 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.061 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -144.65 28.71 1.89 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.817 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -138.47 -9.32 1.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.583 0.23 . . . . 0.0 111.308 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.06 -14.84 5.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.783 0.325 . . . . 0.0 111.007 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.719 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.01 -25.19 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.855 -179.614 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.483 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.0 t80 -42.75 -55.69 6.94 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.169 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 19.3 Cg_endo -59.7 -18.23 46.97 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.976 1.784 . . . . 0.0 112.386 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 53' ' ' LEU . 84.8 mt -99.09 -22.15 15.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.991 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.626 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.9 mm -65.46 -37.87 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.895 0.379 . . . . 0.0 110.431 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.4 mt-30 -53.93 -18.11 3.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.78 -34.57 30.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.08 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.483 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -79.35 -40.78 29.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.067 -178.326 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.735 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.4 m-70 -118.12 159.68 42.17 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.234 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.69 ' HG2' HD23 ' A' ' 85' ' ' LEU . 37.8 Cg_endo -64.71 75.17 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.31 2.007 . . . . 0.0 111.796 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 43.8 p 45.73 36.09 2.54 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.982 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.69 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -87.23 1.84 51.92 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.045 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.658 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -65.72 -143.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.095 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.31 -11.66 60.39 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.301 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.888 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.1 ttpt -160.47 -21.96 0.06 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.812 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -49.03 -80.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.061 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.6 -39.22 67.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.575 0.226 . . . . 0.0 110.768 -179.37 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.66 -27.54 64.04 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.888 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.8 ttm -76.46 -36.42 57.92 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.516 0.674 . . . . 0.0 109.561 177.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.661 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -57.71 -6.83 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.432 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.14 27.39 9.33 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.43 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.6 pt-20 -170.84 2.57 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.091 -0.958 . . . . 0.0 111.357 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.929 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.34 -150.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.456 0.646 . . . . 0.0 111.77 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.563 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 8.1 t0 -59.09 -3.97 0.44 Allowed 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.043 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.585 ' H ' HG12 ' A' ' 96' ' ' ILE . 8.5 m120 78.79 -26.48 0.17 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.483 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.39 -32.12 60.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.103 0.477 . . . . 0.0 109.865 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.929 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.2 mt-10 -74.79 -24.85 58.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.837 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.642 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.7 tp -75.02 -24.66 58.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.958 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.9 mp -90.47 -47.03 7.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.122 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -37.12 85.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.352 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.681 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 6.0 ptm -60.07 -39.07 84.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.742 0.306 . . . . 0.0 110.793 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.588 HD21 ' HB3' ' A' ' 70' ' ' LEU . 59.8 mt -78.33 -13.13 59.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.541 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -109.41 -5.13 15.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.037 -177.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.837 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.7 t -147.31 139.69 14.21 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.228 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.659 ' O ' HG21 ' A' ' 54' ' ' THR . 85.8 Cg_endo -80.05 2.92 8.05 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.981 2.454 . . . . 0.0 112.009 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -122.87 -18.96 6.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.306 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.837 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -72.24 -50.62 25.96 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.889 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.1 tt -50.09 -34.19 21.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.112 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -85.69 -60.04 2.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.228 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.5 m -53.63 -35.86 61.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.866 0.365 . . . . 0.0 111.027 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.647 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.2 mmtt -78.73 -28.59 44.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.557 179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.812 HG13 HG21 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -71.07 -50.63 40.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.388 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.415 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.3 -38.82 81.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.432 177.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.1 -33.32 67.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.595 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.807 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -65.43 -30.11 70.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.656 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.735 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.8 t -56.61 -53.38 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.699 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.33 -25.68 16.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.348 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 5.1 t -86.81 -32.55 6.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.422 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.831 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.28 -39.36 74.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.086 179.077 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.492 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -73.13 -26.91 61.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.659 178.049 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.61 1.73 54.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.504 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.528 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -124.5 -27.24 3.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.934 0.397 . . . . 0.0 110.63 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.606 ' HG3' HD12 ' A' ' 122' ' ' LEU . 58.9 mm-40 -89.41 -76.53 0.41 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.701 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -82.74 8.48 12.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.291 -177.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.66 ' HE3' ' HB2' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -69.76 -149.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.005 0.431 . . . . 0.0 110.574 179.082 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.433 ' C ' ' H ' ' A' ' 131' ' ' ALA . 0.2 OUTLIER -85.91 25.07 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.66 ' HB2' ' HE3' ' A' ' 128' ' ' LYS . . . -72.54 19.53 0.08 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.822 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 129' ' ' GLU . . . -84.98 37.42 0.66 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.886 0.374 . . . . 0.0 111.34 -179.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -79.81 -79.09 0.15 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.971 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -63.75 1.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.8 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.47 117.9 12.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.047 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.3 t -94.23 -51.26 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.048 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -72.66 103.92 3.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.1 51.24 0.95 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 118.67 10.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.103 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.05 178.1 6.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.824 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -88.71 122.67 6.47 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.611 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.541 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 2.6 t -83.78 -51.26 0.63 Allowed Pre-proline 0 C--N 1.329 -0.3 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.541 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 48.3 Cg_exo -56.33 150.37 50.47 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.251 1.967 . . . . 0.0 112.408 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.8 p -102.92 -39.83 6.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.898 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.192 -179.816 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.24 -10.42 25.72 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.569 2.18 . . . . 0.0 112.332 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -70.31 0.7 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.69 111.27 3.91 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.501 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.7 t -86.53 142.09 28.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.11 143.44 32.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.156 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.19 63.04 1.83 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -158.47 153.27 24.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.115 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -114.94 118.21 32.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.044 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.584 ' HB ' ' HD3' ' A' ' 11' ' ' PRO . 3.3 m -63.49 -49.9 75.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.488 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.584 ' HD3' ' HB ' ' A' ' 10' ' ' THR . 52.5 Cg_exo -55.17 125.05 17.87 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.101 1.868 . . . . 0.0 112.219 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.48 34.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.211 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.98 92.11 3.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.043 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.82 156.47 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.15 151.19 23.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.89 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 p -103.24 114.73 64.84 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.838 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.45 96.42 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.497 2.131 . . . . 0.0 112.495 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -91.33 97.05 10.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.738 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -76.36 0.29 20.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.012 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -81.6 73.7 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.822 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -82.36 109.56 16.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.56 133.72 43.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.051 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -173.55 1.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.59 84.15 0.99 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.474 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 13.5 m -101.57 176.28 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.767 0.318 . . . . 0.0 111.102 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.45 123.49 33.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 m-20 -95.93 145.58 29.81 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.986 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.13 -70.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.605 2.203 . . . . 0.0 112.348 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -88.78 109.15 19.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -99.34 -81.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.049 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 -3.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.4 mt -94.44 100.18 12.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -102.47 102.38 12.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 86.27 1.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.084 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -103.41 147.33 34.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -83.08 162.63 73.35 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.478 -1.468 . . . . 0.0 112.393 0.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.56 -172.01 3.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.878 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.85 110.49 14.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.82 130.2 45.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.865 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.419 ' HG3' ' H ' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -84.48 168.37 15.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.92 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.419 ' H ' ' HG3' ' A' ' 40' ' ' MET . 4.5 pt20 -83.78 127.12 33.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.926 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.72 95.15 30.02 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.865 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -67.86 107.91 1.59 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.545 2.163 . . . . 0.0 112.256 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.1 61.18 6.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.4 m -90.17 30.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.107 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -91.4 -74.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 t -102.32 154.61 5.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.023 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -91.0 -2.44 57.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.808 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.52 -150.35 25.24 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.426 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -87.92 129.26 35.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.565 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 1.6 mm-40 -84.69 -50.96 0.57 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.558 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 31.6 Cg_endo -63.47 112.06 1.65 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.204 1.936 . . . . 0.0 112.53 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.782 ' HB2' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -72.03 135.09 46.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.823 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.864 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.14 -176.18 1.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.042 178.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.997 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.48 -43.7 45.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.839 -179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.666 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 50.4 m -60.36 -48.14 83.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.026 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.666 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.22 -42.06 85.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.294 0.569 . . . . 0.0 110.472 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.997 HD12 ' HA ' ' A' ' 55' ' ' ALA . 9.5 mt -62.38 -45.17 94.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.19 -15.22 44.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.966 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 t -76.08 -6.32 50.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -132.69 59.84 46.0 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.104 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.61 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.9 Cg_exo -55.23 -52.65 7.33 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.449 2.099 . . . . 0.0 113.122 -179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.6 Cg_endo -97.97 27.51 0.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.528 2.152 . . . . 0.0 112.81 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.716 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 10.4 tt0 -136.04 -92.56 0.27 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.772 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.01 36.36 2.7 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.038 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.538 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -68.06 -20.74 64.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 110.609 178.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.645 ' HA ' HD11 ' A' ' 70' ' ' LEU . 9.4 pttt -131.43 26.89 4.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.895 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.458 ' N ' HD21 ' A' ' 70' ' ' LEU . 3.9 mt-30 -131.02 -56.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.772 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -77.98 18.35 0.5 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.645 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.1 -32.76 17.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.31 0.576 . . . . 0.0 110.138 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.072 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -131.33 12.6 5.48 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.739 178.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -128.66 -3.42 5.34 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.99 -19.79 4.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.83 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.683 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -77.29 -22.17 52.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.107 -178.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.648 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.8 t80 -44.55 -55.17 10.78 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.102 -177.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 31.5 Cg_exo -60.4 -15.71 37.28 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.166 1.911 . . . . 0.0 112.711 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.782 HD23 ' HB2' ' A' ' 53' ' ' LEU . 0.1 OUTLIER -98.65 -28.41 13.55 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.341 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.8 mm -61.66 -40.52 86.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.577 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.863 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 19.0 mt-30 -52.31 -17.43 1.15 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.914 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.22 -35.65 23.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.079 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.9 -37.62 58.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.925 -179.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.763 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.8 m-70 -121.22 162.64 34.62 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.502 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -67.46 71.67 0.64 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.298 1.998 . . . . 0.0 111.86 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.863 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.4 p 49.11 32.35 4.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.119 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 27.4 mt -84.71 5.91 26.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.22 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.53 -141.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.898 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.31 -10.67 34.49 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.456 -0.878 . . . . 0.0 111.608 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.857 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.1 OUTLIER -156.3 -25.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 179.791 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.849 HG21 HG13 ' A' ' 115' ' ' VAL . 56.6 mt -49.26 -85.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-O 120.629 0.252 . . . . 0.0 111.558 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.072 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.98 -40.0 66.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.0 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.59 -30.02 58.55 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.168 -1.015 . . . . 0.0 111.029 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.857 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.77 -25.62 32.61 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.77 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.3 mm? -60.77 -8.08 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.677 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.561 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.9 mm? -105.79 25.84 10.35 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.568 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 3.9 pt-20 -167.3 1.58 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.547 -178.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.899 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.0 -152.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.448 0.642 . . . . 0.0 111.963 -179.137 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.5 t70 -59.08 -2.95 0.3 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.272 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.7 m-80 78.14 -28.78 0.16 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.28 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -72.59 -31.03 64.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.132 0.491 . . . . 0.0 109.839 177.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.899 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.8 OUTLIER -78.17 -22.29 48.9 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.633 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.4 tp -75.14 -24.74 58.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.782 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.403 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.6 mp -91.15 -47.3 7.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.221 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -37.18 86.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.59 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.804 ' HB2' HD22 ' A' ' 111' ' ' LEU . 8.3 ptm -59.53 -38.74 81.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.572 0.225 . . . . 0.0 111.033 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 58' ' ' LEU . 4.0 mt -86.62 -7.71 58.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.11 0.481 . . . . 0.0 110.093 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 68.7 mm-40 -108.99 -5.8 15.92 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.771 -177.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.721 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.3 t -146.05 130.95 8.98 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 111.447 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.472 ' O ' HG21 ' A' ' 54' ' ' THR . 57.0 Cg_endo -70.68 8.6 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.552 2.168 . . . . 0.0 112.076 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.67 -27.51 2.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.308 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.721 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -63.95 -44.57 92.4 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.054 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.15 -42.23 13.63 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 175.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.437 ' HG2' ' N ' ' A' ' 113' ' ' SER . 2.3 ttt180 -79.68 -64.91 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.522 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.437 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 33.3 t -48.65 -52.63 22.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.788 0.328 . . . . 0.0 111.328 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 10.5 mmtm -60.21 -30.96 69.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.05 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.849 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.19 -53.76 20.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -36.91 62.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.031 0.443 . . . . 0.0 110.491 177.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.81 -33.96 60.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.985 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.12 -24.37 65.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.043 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.763 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -65.49 -49.2 79.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.68 176.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.83 -27.49 60.2 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.6 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 6.5 t -84.43 -30.28 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.691 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.16 -37.99 61.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.157 179.122 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -75.28 -20.25 59.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.028 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.48 -15.69 34.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.636 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -113.21 -50.9 2.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.187 -178.413 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 122' ' ' LEU . 46.2 mm-40 -57.23 -67.9 0.28 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -94.22 53.63 1.76 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . 3.9 pttt -64.18 118.01 7.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.626 -175.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.423 ' HG3' ' H ' ' A' ' 129' ' ' GLU . 0.0 OUTLIER -83.19 8.47 13.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.225 178.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -85.5 20.5 2.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.005 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.1 -2.06 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.021 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -74.0 -62.53 1.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 74.13 10.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.66 -49.17 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.068 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.0 m -94.31 167.76 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.215 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -79.27 -11.9 59.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.915 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.2 p -94.71 140.21 30.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.917 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.93 167.18 19.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.067 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 27.8 p -109.46 139.77 44.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -91.84 145.19 17.58 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.526 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 29.5 t -99.22 122.88 50.68 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.489 0.185 . . . . 0.0 111.027 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.55 125.33 13.69 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.508 2.139 . . . . 0.0 112.234 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 28.3 m -76.83 -29.52 55.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.957 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.084 -179.923 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 CA-C-O 120.156 -0.247 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -78.82 -164.3 3.91 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 123.394 -1.502 . . . . 0.0 112.35 0.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 85.28 5.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.845 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.88 -165.49 37.49 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.634 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.94 -175.36 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.781 0.324 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.61 103.84 5.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.122 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -84.54 166.04 17.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.078 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.03 127.65 15.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.218 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 55.93 88.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.288 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.431 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 2.7 t -133.5 124.77 18.25 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.938 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 10' ' ' THR . 26.6 Cg_exo -63.12 87.26 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.591 2.194 . . . . 0.0 112.318 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.56 0.15 38.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.993 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.5 m -101.58 125.69 55.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.043 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 mtm-85 -95.59 104.0 15.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.008 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.74 88.5 2.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.924 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -104.28 143.42 26.64 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -74.54 163.1 91.21 Favored 'Cis proline' 0 C--N 1.349 0.56 0 C-N-CA 123.676 -1.385 . . . . 0.0 112.14 0.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -85.49 -178.97 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.844 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -66.1 173.54 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.464 ' HG3' ' H ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -100.27 12.49 36.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.778 179.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -93.59 108.61 20.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.969 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.13 -75.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.37 53.07 2.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.14 -1.26 48.13 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.555 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -104.71 108.75 25.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.937 0.398 . . . . 0.0 110.981 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.496 ' HG3' ' H ' ' A' ' 27' ' ' ASN . 0.9 OUTLIER -85.84 180.0 6.93 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.987 -179.732 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.496 ' H ' ' HG3' ' A' ' 26' ' ' ARG . 89.6 m-20 -88.87 154.54 50.08 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.781 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -82.82 175.26 39.42 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.515 -1.452 . . . . 0.0 112.429 0.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.12 -163.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.84 167.85 16.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.774 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -123.48 68.63 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.928 0.394 . . . . 0.0 111.027 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mp -80.46 161.01 25.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.858 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -91.46 42.16 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.994 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.54 -5.52 55.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.94 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.6 116.86 59.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.935 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.01 -26.41 31.14 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.585 2.19 . . . . 0.0 112.205 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.82 46.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.058 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 p -82.24 122.37 36.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.27 77.66 1.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.1 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.5 ptt? -95.22 -14.05 24.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -154.13 146.25 23.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.738 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.99 110.93 3.08 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.179 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.81 90.89 0.82 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.578 2.185 . . . . 0.0 112.181 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.37 127.23 32.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.207 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.67 144.38 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.854 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.08 -79.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.2 p -86.23 145.02 8.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.08 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 171.64 7.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.97 70.0 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.672 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.0 87.47 4.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.804 0.335 . . . . 0.0 110.809 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.742 ' H ' ' HA ' ' A' ' 52' ' ' PRO . 3.8 mm-40 -90.84 -48.46 0.36 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.964 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.742 ' HA ' ' H ' ' A' ' 51' ' ' GLU . 67.4 Cg_endo -89.93 -173.71 7.3 Favored 'Cis proline' 0 C--N 1.356 0.953 0 C-N-CA 124.657 -0.976 . . . . 0.0 112.772 1.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.848 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -69.29 145.05 53.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.269 -179.502 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.797 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.46 -158.82 0.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.279 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.752 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -60.62 -40.64 92.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.447 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.3 m -58.27 -46.15 86.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.398 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.848 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.45 -43.33 93.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.12 178.558 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.752 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -55.93 -48.74 75.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.487 178.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.29 -9.69 49.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.665 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.7 m -84.73 -8.38 58.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.217 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.542 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -135.14 56.43 16.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.553 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.542 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 92.2 Cg_endo -96.99 127.55 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.909 2.406 . . . . 0.0 112.845 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.476 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 74.5 Cg_endo -98.7 21.24 24.35 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.248 -1.147 . . . . 0.0 112.318 -0.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.404 ' HB3' ' H ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -50.79 -84.84 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.566 -178.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.481 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 1.7 mm-40 -104.21 20.6 18.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.852 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.529 ' HG3' ' HB3' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -57.42 -32.17 66.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.001 179.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.627 ' C ' HD21 ' A' ' 70' ' ' LEU . 35.9 mtmt -131.94 29.21 4.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.216 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 4.0 mt-30 -127.37 -48.1 1.44 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.56 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -81.03 13.76 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.179 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.798 HD22 ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -81.55 -40.35 23.24 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 120.906 0.384 . . . . 0.0 110.121 179.328 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.052 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.8 36.13 2.41 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.84 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 1.4 pt-20 -150.85 -11.85 0.23 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.434 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.92 -15.29 5.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 110.687 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.708 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.92 -12.43 59.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.31 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.476 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 9.1 t80 -48.19 -54.91 21.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.818 -177.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.7 Cg_endo -65.03 -8.08 17.2 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.114 1.876 . . . . 0.0 112.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.589 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.6 mm? -98.54 -28.19 13.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.267 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.779 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.7 mm -69.13 -40.38 80.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.322 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.937 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.9 mt-30 -51.19 -18.3 0.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.281 0.562 . . . . 0.0 110.355 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.35 -39.98 22.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.211 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.779 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.74 -44.35 61.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.091 0.472 . . . . 0.0 110.742 -179.596 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.738 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.7 m-70 -115.51 155.76 46.84 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.642 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -62.92 76.18 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.508 2.139 . . . . 0.0 111.736 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.937 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.5 p 46.84 33.7 2.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.133 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.701 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 17.9 mt -87.18 6.41 33.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.211 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.672 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.6 -137.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.961 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.1 -15.86 25.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.769 -178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.886 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.0 ttpt -156.62 -21.6 0.1 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.845 HG21 HG13 ' A' ' 115' ' ' VAL . 62.0 mt -49.54 -81.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.052 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -54.26 -39.3 66.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.455 0.169 . . . . 0.0 110.795 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.07 -28.03 63.3 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.093 -1.051 . . . . 0.0 110.573 176.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.886 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.7 ttm -76.32 -36.87 58.07 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.521 0.677 . . . . 0.0 109.793 177.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 89' ' ' ILE . 4.5 mm? -56.98 -6.32 0.34 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.561 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 70' ' ' LEU . 2.3 mm? -108.75 27.7 9.17 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.419 ' H ' ' H ' ' A' ' 96' ' ' ILE . 6.5 pt-20 -170.1 1.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.195 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.958 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.16 -153.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 121.4 0.619 . . . . 0.0 111.616 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 96' ' ' ILE . 7.6 t0 -59.34 -3.14 0.37 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.139 178.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.58 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.9 -35.14 0.17 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.264 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -67.32 -25.77 66.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.833 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.958 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.56 -24.67 31.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.858 177.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -74.95 -27.19 60.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.54 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.7 mp -86.69 -46.83 9.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.36 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -37.93 85.06 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.201 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.771 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.86 -36.09 74.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.157 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 16.3 mt -86.92 -9.92 54.53 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.136 0.493 . . . . 0.0 110.1 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -107.5 -6.44 17.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.258 -176.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.856 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -148.71 130.33 7.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.636 0.255 . . . . 0.0 111.518 -179.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.482 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.57 -0.53 6.08 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.926 2.417 . . . . 0.0 112.465 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -123.69 -13.66 7.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.535 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.856 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -71.94 -46.04 58.96 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.016 0.436 . . . . 0.0 110.202 178.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.797 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.4 tt -56.17 -29.23 60.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.12 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -88.2 -51.64 5.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.266 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 m -64.02 -35.1 79.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.958 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 27.0 mmtt -78.98 -29.5 43.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.58 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.81 -51.44 40.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.158 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.65 -37.76 73.9 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.378 178.695 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -37.58 70.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.696 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.87 -26.97 69.03 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.962 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.738 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.5 t -62.13 -47.69 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.305 0.574 . . . . 0.0 109.807 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.73 -24.27 61.25 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.857 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.467 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 8.9 t -87.15 -35.42 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.421 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.78 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -66.31 -38.68 88.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 4.6 mm-40 -71.99 -29.11 63.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.406 176.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.499 ' C ' ' HG2' ' A' ' 128' ' ' LYS . . . -89.61 10.63 22.37 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.558 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.4 OUTLIER -136.59 -15.96 1.58 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.815 0.341 . . . . 0.0 110.979 179.064 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -88.67 -78.88 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.727 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.63 15.27 8.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.077 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.557 ' HD3' ' N ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -84.61 -158.14 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.837 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -87.32 27.08 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.462 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.557 ' N ' ' HD3' ' A' ' 128' ' ' LYS . . . -61.25 -28.38 69.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.412 -177.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.13 168.32 10.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -75.89 -62.41 1.6 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 5.0 pttm -80.55 141.34 35.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.049 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.82 85.82 7.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.042 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.17 158.32 2.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.44 83.6 0.81 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 54.2 p -96.24 138.12 34.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.897 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -89.69 125.11 35.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.107 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 1.2 t -98.39 126.03 43.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.79 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -103.96 37.39 3.78 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.509 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 37.6 t -101.45 129.72 26.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.433 0.158 . . . . 0.0 111.002 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.27 169.87 67.65 Favored 'Cis proline' 0 C--N 1.348 0.539 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.479 0.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 29.1 p -105.44 14.7 28.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.856 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.17 -179.864 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.117 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.62 -65.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.608 2.206 . . . . 0.0 112.166 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -91.79 101.56 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.863 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -106.41 134.35 12.09 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.594 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.1 t -102.31 -17.11 16.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.825 0.345 . . . . 0.0 110.917 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -135.55 141.81 45.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.998 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.64 -73.04 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.093 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -144.3 -44.62 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.09 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.47 124.92 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.71 -51.64 0.1 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.553 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -56.43 118.01 4.76 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.142 1.895 . . . . 0.0 112.294 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.57 13.26 22.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -107.79 82.75 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.159 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 14' ' ' ARG . 18.1 mtt85 -80.66 -67.23 0.79 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.75 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 m -95.14 140.18 30.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.757 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.475 HG12 ' HD2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -108.74 136.88 19.94 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.564 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.475 ' HD2' HG12 ' A' ' 16' ' ' VAL . 61.4 Cg_endo -73.54 -30.69 9.62 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.443 2.096 . . . . 0.0 112.133 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -93.39 161.02 14.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.81 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -63.96 129.19 39.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' H ' ' HG2' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -87.29 -163.95 1.01 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.973 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -86.25 39.09 0.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.012 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.02 -59.01 2.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.61 108.79 1.79 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -107.43 0.43 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.436 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.2 t -97.72 120.83 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.853 0.358 . . . . 0.0 111.138 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.435 ' HE ' ' HB2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -98.53 -55.87 2.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.863 179.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -82.76 139.36 43.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.953 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -77.66 69.85 7.15 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.604 2.203 . . . . 0.0 112.363 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.54 124.19 34.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -98.74 119.05 36.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.0 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -77.8 -16.92 58.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 120.04 19.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.886 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -104.95 -12.48 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.907 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.488 ' HB1' ' HB2' ' A' ' 37' ' ' GLN . . . -84.97 104.66 15.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.073 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.682 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 36.6 mt-30 -98.51 -52.05 0.21 Allowed Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.409 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.682 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 12.6 Cg_exo -70.78 -5.95 18.0 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.379 2.053 . . . . 0.0 112.185 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.488 ' HB2' ' HB1' ' A' ' 34' ' ' ALA . 2.0 tp60 -81.92 113.47 19.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.102 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.41 18.66 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 15.0 t -80.2 177.08 9.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.998 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.2 mtt -93.5 -169.41 2.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -100.47 153.34 19.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -154.11 135.68 9.01 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.2 132.3 46.06 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.524 2.149 . . . . 0.0 112.164 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.48 95.11 8.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.073 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.442 HG21 ' HG2' ' A' ' 109' ' ' GLU . 14.7 p -96.75 -27.65 3.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.986 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.39 96.27 8.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 m -109.18 -177.75 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.037 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -55.34 7.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.53 158.4 18.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.372 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -108.26 85.79 2.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.907 0.384 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 20.7 mm-40 -90.69 -50.98 0.33 Allowed Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.363 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.494 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 48.9 Cg_exo -56.98 152.8 41.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.208 1.939 . . . . 0.0 112.267 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.749 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -89.35 148.61 23.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.893 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.791 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.79 -161.86 0.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.666 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -59.59 -36.92 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.382 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 108' ' ' PRO . 2.0 m -60.73 -45.7 93.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.405 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.689 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.81 -40.96 94.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.262 0.553 . . . . 0.0 110.113 178.371 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.629 HD22 ' HA ' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -58.04 -47.88 81.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.721 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.41 -8.88 50.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 t -81.75 -9.51 59.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.007 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.638 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -135.12 60.35 39.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.163 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.632 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 51.3 Cg_exo -53.71 -51.48 10.72 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.413 2.075 . . . . 0.0 113.139 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.591 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 78.8 Cg_endo -97.44 31.05 0.15 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.591 2.194 . . . . 0.0 112.676 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.638 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 3.0 tp-100 -142.67 -93.54 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.536 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.714 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -106.88 43.87 1.12 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.55 -178.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.632 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -72.8 -31.78 65.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.932 0.396 . . . . 0.0 110.967 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.569 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -128.49 34.85 4.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.49 ' N ' HD21 ' A' ' 70' ' ' LEU . 38.2 tt0 -133.29 -53.86 0.9 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.876 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.714 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.2 ptt? -80.63 22.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.599 HD23 ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.16 -40.9 12.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.118 0.485 . . . . 0.0 110.196 179.384 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.974 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -125.64 13.79 7.27 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -130.1 -2.4 4.56 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.511 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 20.4 tpp180 -127.11 -22.9 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.081 0.467 . . . . 0.0 111.107 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.99 -17.82 60.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.008 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 11.2 t80 -46.02 -54.88 14.95 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 27.6 Cg_endo -62.17 -15.27 43.15 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.121 1.88 . . . . 0.0 112.506 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.749 HD12 ' HB2' ' A' ' 53' ' ' LEU . 54.2 mt -98.74 -23.38 15.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.898 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 74' ' ' LEU . 10.2 mm -66.37 -41.28 88.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.371 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.6 mt-30 -53.25 -18.37 2.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.58 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.56 -36.09 29.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.84 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.421 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.84 -51.29 14.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.68 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.749 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.2 m-70 -105.16 160.85 24.6 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.237 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.407 ' HD2' HD12 ' A' ' 85' ' ' LEU . 46.4 Cg_endo -67.4 71.72 0.62 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.287 1.991 . . . . 0.0 111.949 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 50.84 38.98 21.25 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.857 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.563 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 25.2 mt -95.42 9.87 38.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.313 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -68.35 -141.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.733 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.45 -25.03 7.53 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.654 -178.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 92' ' ' MET . 0.0 OUTLIER -156.38 12.28 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.46 0.171 . . . . 0.0 111.362 178.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.784 HG21 HG13 ' A' ' 115' ' ' VAL . 88.0 mt -76.19 -89.23 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 119.811 -0.755 . . . . 0.0 110.202 178.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.974 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.38 -40.64 59.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.075 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.66 -32.4 54.04 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.31 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.763 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -83.92 -23.12 31.32 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.815 0.341 . . . . 0.0 110.199 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.603 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.39 -6.66 2.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.389 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.589 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.7 mm? -105.14 24.25 12.33 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 176.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.3 pt-20 -166.86 1.73 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.704 -178.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.903 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.98 -151.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.376 0.608 . . . . 0.0 111.826 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 5.9 t0 -59.23 -3.44 0.4 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.143 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.596 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.3 m-20 78.08 -28.61 0.16 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.509 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.2 m -74.72 -25.15 58.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.903 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.5 OUTLIER -82.64 -26.15 32.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.596 177.251 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 94' ' ' LEU . 2.7 tp -75.06 -25.91 59.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.467 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.1 -47.64 9.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.065 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.417 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.74 -37.87 82.76 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.3 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.705 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -58.22 -35.97 72.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.268 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.588 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.5 mt -87.05 -12.85 46.08 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.259 0.552 . . . . 0.0 110.068 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 57.6 mm-40 -102.49 -8.01 21.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.19 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.834 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -147.32 134.5 10.22 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.677 0.275 . . . . 0.0 111.722 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 54' ' ' THR . 59.4 Cg_endo -72.18 2.19 5.22 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.69 2.26 . . . . 0.0 112.24 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 113' ' ' SER . 5.7 mt-10 -126.71 -13.7 5.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.576 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.834 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -73.11 -45.13 58.79 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.045 0.45 . . . . 0.0 110.051 177.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.791 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.0 tt -56.88 -30.74 64.17 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.119 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -89.76 -44.75 9.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.301 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -68.03 -35.66 78.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.699 -179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.573 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 23.7 mmtt -78.79 -29.42 44.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.49 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.784 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.56 -52.19 31.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.473 ' CG ' ' HE2' ' A' ' 82' ' ' HIS . 7.0 t70 -59.0 -34.88 72.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.394 177.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -29.26 48.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.868 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.763 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.99 -25.31 63.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.781 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.749 HG11 ' ND1' ' A' ' 82' ' ' HIS . 13.1 t -64.96 -51.49 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.877 177.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.35 -24.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.531 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.69 -31.96 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.82 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.68 -37.1 62.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -77.62 -22.72 50.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.098 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -81.65 -15.71 53.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.318 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -107.43 -45.5 4.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -59.0 -79.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.45 62.74 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' A' ' 128' ' ' LYS . 3.0 ptpt -64.13 123.82 20.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.79 -174.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.21 4.49 42.33 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.656 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.64 -21.28 60.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.295 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.96 126.68 31.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.988 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -72.59 -71.87 0.27 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.982 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.73 70.36 9.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.971 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.08 141.0 28.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.028 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 6.7 m -76.96 136.94 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -87.29 148.0 25.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.7 m -98.49 -21.49 16.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.944 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.95 125.92 28.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.191 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.3 156.28 18.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.896 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -101.62 -159.99 26.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.501 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.449 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 1.3 t -84.7 124.13 73.4 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.595 0.236 . . . . 0.0 111.004 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 141' ' ' VAL . 16.9 Cg_exo -67.5 82.14 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.686 2.258 . . . . 0.0 112.182 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.81 172.01 8.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.964 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.038 -179.875 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HB2' ' HB3' ' A' ' 5' ' ' SER . 38.3 Cg_exo -57.32 152.73 44.42 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.597 2.198 . . . . 0.0 112.252 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.1 mt -92.49 -34.13 14.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.67 45.84 1.57 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.397 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' A' ' 2' ' ' PRO . 23.8 p -100.46 -5.34 27.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.722 0.296 . . . . 0.0 111.068 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.88 -41.51 97.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -85.41 -178.85 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.999 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.86 -69.51 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.997 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -162.8 -40.27 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.012 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.2 p -134.62 123.46 16.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.13 -11.72 27.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.47 2.113 . . . . 0.0 112.27 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.44 71.63 10.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.032 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.4 t -107.17 139.24 29.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.081 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -90.23 68.45 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.842 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.81 140.59 37.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.538 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -97.89 -51.06 0.22 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.591 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.538 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 72.6 Cg_endo -76.12 68.61 6.6 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.186 1.924 . . . . 0.0 112.379 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -75.16 -173.1 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.946 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -79.3 59.52 2.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.55 140.1 37.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -66.38 104.82 1.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.973 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.71 -10.47 37.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.86 146.01 26.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.979 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.83 97.59 2.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.54 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.5 m -82.35 -39.67 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.839 0.352 . . . . 0.0 111.005 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.475 ' O ' ' HD3' ' A' ' 28' ' ' PRO . 9.9 mmt-85 -81.17 133.32 35.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.93 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -96.34 105.58 23.37 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.475 ' HD3' ' O ' ' A' ' 26' ' ' ARG . 31.3 Cg_exo -59.35 92.19 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.567 2.178 . . . . 0.0 112.338 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.48 ' H ' ' HG2' ' A' ' 29' ' ' GLN . 2.8 pt20 -99.74 97.96 8.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.769 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -69.83 122.17 18.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.166 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -110.42 34.51 3.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.737 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -83.01 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.57 125.24 40.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.096 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.72 -3.48 58.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -101.16 133.89 20.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.925 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -57.64 167.85 3.61 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.559 2.173 . . . . 0.0 112.391 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.11 162.4 14.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.883 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.0 t -105.2 -66.8 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.345 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.9 m -86.52 -31.8 21.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.255 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.39 79.08 8.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.116 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -166.0 125.3 1.63 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -122.24 76.59 42.73 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.28 97.91 0.71 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.85 116.07 21.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.0 p -99.57 156.23 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.895 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.5 m80 -79.9 121.7 25.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.028 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 65.5 t -99.61 127.43 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.963 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -93.78 109.99 21.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.939 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.52 41.0 3.03 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.396 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.29 59.53 3.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.866 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -90.9 106.83 17.07 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.1 -173.13 1.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.459 2.106 . . . . 0.0 112.104 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.654 HD22 HD22 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -83.71 151.76 25.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.907 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.687 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.12 -169.57 1.5 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.969 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.979 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -56.84 -31.96 65.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -50.64 61.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.676 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -57.75 -36.38 72.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.915 178.716 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.979 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.0 mt -68.22 -41.57 81.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.417 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.499 ' O ' ' HD3' ' A' ' 62' ' ' PRO . . . -61.71 -12.69 17.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.913 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 m -75.29 -13.56 60.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.62 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.798 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . . . -141.61 58.94 9.16 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.107 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 53.7 Cg_exo -51.82 -51.56 10.89 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.444 2.096 . . . . 0.0 113.063 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.598 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 65.5 Cg_endo -95.76 23.2 0.38 Allowed 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.753 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 28.2 tp60 -135.73 -90.65 0.3 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.798 ' HG2' ' HB3' ' A' ' 61' ' ' ALA . 1.1 pt-20 -106.88 29.56 6.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.755 0.312 . . . . 0.0 111.818 -176.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -67.31 -60.09 2.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.576 178.733 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.434 ' O ' HD11 ' A' ' 70' ' ' LEU . 2.7 pttm -90.16 29.74 1.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.448 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.494 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -124.71 -46.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.967 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.738 ' HG3' ' HG3' ' A' ' 65' ' ' GLU . 43.7 mtm -74.49 -8.98 58.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.696 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.786 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -57.94 -52.53 65.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.66 0.267 . . . . 0.0 111.343 -177.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -123.6 23.54 6.68 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.329 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.494 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 2.2 mt-10 -136.73 2.31 2.64 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.466 0.174 . . . . 0.0 111.461 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.645 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -125.67 -34.52 2.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.656 ' HB3' HD11 ' A' ' 78' ' ' ILE . 2.3 mm? -59.5 -38.48 81.01 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.777 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -26.88 -61.54 0.18 Allowed Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -175.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.777 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 15.9 Cg_exo -69.18 -30.38 25.05 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.078 1.852 . . . . 0.0 112.273 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.9 mt -82.12 -17.6 45.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.972 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.656 HD11 ' HB3' ' A' ' 74' ' ' LEU . 11.4 mm -73.18 -43.18 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.88 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.4 mt-30 -50.88 -19.54 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.892 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.67 -40.18 29.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.886 178.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.487 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.79 -50.86 31.2 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.494 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.743 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.2 m-70 -109.08 153.76 42.38 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.572 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.458 ' HG2' HD13 ' A' ' 85' ' ' LEU . 26.1 Cg_endo -61.74 81.0 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.339 2.026 . . . . 0.0 111.789 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.88 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 42.0 33.47 0.37 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.641 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.537 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.8 mp -87.63 8.92 23.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.878 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.457 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -75.72 40.42 0.19 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.75 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.18 -12.64 81.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.758 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.783 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.1 ttpt -178.0 34.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.868 0.366 . . . . 0.0 110.668 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.811 HG21 HG13 ' A' ' 115' ' ' VAL . 61.7 mt -80.09 -91.88 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.85 -40.59 56.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.997 179.694 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.54 53.91 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.144 -1.026 . . . . 0.0 110.916 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.783 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.39 -25.48 33.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.508 -0.346 . . . . 0.0 110.133 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.623 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.5 mm? -59.83 -7.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.786 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -104.98 27.17 8.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -168.89 2.18 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.596 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.943 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.96 -152.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.385 0.612 . . . . 0.0 111.712 -179.723 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.542 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.4 t0 -59.43 -3.05 0.38 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.087 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 78.63 -29.94 0.15 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.493 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m -73.61 -27.87 61.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.045 0.45 . . . . 0.0 109.956 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.943 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -79.77 -23.48 42.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.097 177.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.16 -25.23 58.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.833 176.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.736 HD12 HD23 ' A' ' 101' ' ' LEU . 2.6 mp -88.4 -45.56 9.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.085 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.422 ' CD2' ' HE2' ' A' ' 114' ' ' LYS . 1.2 t60 -61.94 -45.95 91.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.759 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.692 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -54.09 -32.74 55.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.409 -179.574 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.813 HD23 HD13 ' A' ' 58' ' ' LEU . 66.5 mt -85.13 -11.68 54.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.801 0.334 . . . . 0.0 111.154 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -110.18 -6.12 15.16 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.549 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -146.8 140.18 14.86 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.678 -0.409 . . . . 0.0 112.064 -178.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.57 ' O ' HG21 ' A' ' 54' ' ' THR . 77.0 Cg_endo -77.01 3.69 6.41 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.668 2.246 . . . . 0.0 112.056 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -122.01 -22.61 5.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.536 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.549 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.2 p -64.35 -56.94 11.03 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 109.959 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 54' ' ' THR . 6.9 tt -51.64 -28.3 13.99 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.734 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.426 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.9 ttt85 -89.86 -60.82 1.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.08 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.426 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 50.3 m -55.65 -34.99 65.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.075 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.563 ' HD3' ' HB3' ' A' ' 100' ' ' GLU . 9.1 mttm -79.2 -32.99 44.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.714 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.811 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -66.54 -53.61 33.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 177.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.89 -35.72 69.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.375 178.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.09 -30.16 60.84 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.948 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.98 -19.64 61.85 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.615 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.743 HG11 ' ND1' ' A' ' 82' ' ' HIS . 18.1 t -68.49 -49.16 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.674 176.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.2 -27.38 63.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.603 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.486 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 7.7 t -85.32 -31.92 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.477 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.69 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.99 -41.92 73.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.826 178.697 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.509 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mm100 -68.82 -27.92 66.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.413 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.731 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -86.06 -12.85 49.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.891 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -115.86 8.25 14.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.971 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 123' ' ' GLN . 8.9 mt-30 -78.14 -103.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.813 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.62 20.14 10.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 111.241 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.731 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 2.8 mttm -81.77 -144.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.959 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -80.48 8.78 6.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.971 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -80.92 -14.08 58.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.195 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.06 -15.1 58.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.24 98.18 11.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.2 111.93 19.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.891 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.02 143.05 31.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.088 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.1 m -103.93 96.82 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.137 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -93.01 -4.86 51.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.899 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 47.5 p -95.36 -31.92 13.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.934 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -86.05 -179.53 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.06 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.17 -177.25 3.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.835 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.97 -107.69 0.15 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.485 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.05 136.97 19.37 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.557 0.218 . . . . 0.0 111.017 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.33 136.28 62.41 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.57 2.18 . . . . 0.0 112.334 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.1 p -88.24 78.08 8.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.036 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.5 t . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.27 -0.872 . . . . 0.0 111.051 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 CA-C-O 120.152 -0.249 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.44 127.31 25.68 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.729 2.286 . . . . 0.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.92 -23.59 17.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.947 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.31 142.83 15.73 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.419 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.3 p -79.68 82.79 5.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.832 0.348 . . . . 0.0 110.88 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -117.18 -179.12 3.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.09 19.36 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.071 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 57.01 27.41 13.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.207 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -126.64 -59.8 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.77 125.87 7.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.812 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.83 85.08 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.444 2.096 . . . . 0.0 112.302 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.7 75.21 9.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.039 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 m -103.73 137.0 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.135 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -99.62 99.24 10.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.856 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -92.62 70.49 4.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.968 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.651 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 42.3 t -109.01 -52.05 0.07 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.631 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.651 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 46.5 Cg_exo -56.38 161.56 9.2 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.189 1.926 . . . . 0.0 112.27 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -77.22 177.38 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.59 -88.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -174.26 5.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -86.71 -18.65 30.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.909 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.68 119.52 19.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.057 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.93 128.81 36.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.77 43.29 3.22 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.485 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -109.67 169.77 3.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.362 . . . . 0.0 111.079 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.8 137.93 38.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -73.56 140.15 78.46 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.03 13.35 2.01 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.536 2.158 . . . . 0.0 112.404 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.97 150.65 20.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.961 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -78.43 -163.73 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.27 -34.84 72.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.3 tp -83.83 134.64 34.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -82.77 134.13 35.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.969 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.92 -86.3 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.064 0.459 . . . . 0.0 111.101 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.16 145.22 32.43 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -77.84 133.43 30.23 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.377 -1.51 . . . . 0.0 112.428 0.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -179.74 3.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 38' ' ' VAL . 2.9 p -78.32 87.21 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.5 -63.87 1.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.921 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.72 148.59 24.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.926 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.1 -159.74 0.99 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.851 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 133.12 83.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.955 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.71 140.52 39.27 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.455 2.103 . . . . 0.0 112.314 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.43 96.97 4.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.098 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.3 t -93.61 92.3 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.02 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 63.1 m80 -107.63 19.71 19.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 t -101.11 54.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.45 8.49 27.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -82.08 -18.45 67.21 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.595 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -100.37 122.47 43.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.818 0.342 . . . . 0.0 110.975 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.65 137.77 54.76 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.979 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.468 ' O ' ' HG2' ' A' ' 57' ' ' MET . 95.3 Cg_endo -80.97 163.57 20.42 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.616 2.211 . . . . 0.0 112.636 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.662 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER -81.0 137.21 36.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.844 179.692 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.573 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -173.51 -174.27 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.278 178.42 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 1.044 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -49.66 -42.13 44.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.793 -178.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.514 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 49.8 m -59.24 -52.3 66.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 110.679 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.514 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -57.8 -40.24 79.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.044 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.9 mt -61.65 -44.33 97.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.048 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -16.53 51.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.976 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.2 t -73.93 -7.03 50.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -133.23 60.78 50.96 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.194 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.603 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 47.5 Cg_exo -55.57 -53.08 6.21 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.436 2.091 . . . . 0.0 113.06 -178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 62.5 Cg_endo -97.66 22.08 0.33 Allowed 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.536 2.157 . . . . 0.0 112.532 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.696 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 4.4 mm100 -127.69 -95.1 0.43 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.852 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.748 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -106.98 37.76 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -177.259 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.468 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -70.11 -18.26 63.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.912 179.355 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.636 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -132.32 24.16 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.111 179.746 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.443 ' N ' HD21 ' A' ' 70' ' ' LEU . 16.2 tt0 -131.72 -52.82 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.748 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -77.62 15.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.296 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.815 HD13 HD21 ' A' ' 105' ' ' LEU . 0.1 OUTLIER -88.86 -28.86 20.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.266 0.555 . . . . 0.0 110.139 179.267 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.053 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.77 11.61 5.15 Favored Glycine 0 N--CA 1.441 -0.988 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.597 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -130.74 -0.69 4.29 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.544 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.17 -21.3 3.95 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.9 0.381 . . . . 0.0 110.702 179.385 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.662 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.09 -15.14 60.16 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.032 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.706 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 3.0 t80 -40.06 -54.6 4.36 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.272 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 12.6 Cg_exo -70.33 -22.59 29.27 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.175 1.916 . . . . 0.0 112.125 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.0 OUTLIER -79.61 -31.5 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.717 -178.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.772 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 7.0 mm -68.69 -42.44 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.855 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.934 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 5.1 mt-30 -50.78 -18.26 0.7 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.323 0.582 . . . . 0.0 110.366 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.0 -41.58 20.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.835 178.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.772 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.5 OUTLIER -69.19 -43.71 73.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.464 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.784 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 3.4 m-70 -118.78 149.38 46.38 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.302 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.798 ' HG2' HD13 ' A' ' 85' ' ' LEU . 20.8 Cg_endo -59.67 77.68 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.299 2.0 . . . . 0.0 111.594 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.934 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 16.3 p 47.02 35.54 3.45 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.87 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 83' ' ' PRO . 0.8 OUTLIER -89.04 2.89 53.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.235 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -61.26 -114.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.756 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.597 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 63.39 -1.37 2.19 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.121 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.741 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -175.98 -20.62 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.816 HG21 HG13 ' A' ' 115' ' ' VAL . 69.8 mt -50.17 -84.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -177.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.053 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -53.53 -38.17 63.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.533 0.206 . . . . 0.0 110.949 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.11 -29.81 60.03 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.59 176.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.581 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.3 ttp -76.34 -35.09 58.92 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.072 -0.564 . . . . 0.0 110.021 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.65 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.28 -11.02 1.02 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.77 -177.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.621 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.68 28.25 7.66 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.414 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.0 pt-20 -172.86 2.5 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.827 -178.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.969 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.69 -149.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.433 0.635 . . . . 0.0 111.629 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.598 ' N ' HG12 ' A' ' 96' ' ' ILE . 13.0 t0 -53.16 -10.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.852 176.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.709 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.3 OUTLIER 80.6 -25.08 0.18 Allowed 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.824 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -73.48 -31.02 63.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.969 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -73.18 -33.52 65.47 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.82 177.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.52 ' N ' HD11 ' A' ' 96' ' ' ILE . 2.3 tm? -65.72 -24.12 66.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.296 178.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.9 mp -89.51 -48.25 7.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.26 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -37.32 81.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.286 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.672 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -59.72 -35.39 74.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.168 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.815 HD21 HD13 ' A' ' 70' ' ' LEU . 15.3 mt -86.78 -11.3 51.4 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.091 0.472 . . . . 0.0 110.066 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -105.63 -7.89 18.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.37 -175.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.863 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -146.58 131.72 9.05 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.673 0.273 . . . . 0.0 111.595 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.537 ' O ' HG21 ' A' ' 54' ' ' THR . 56.4 Cg_endo -70.66 2.54 3.93 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.635 2.223 . . . . 0.0 112.257 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -125.37 -16.66 5.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.699 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.863 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.3 OUTLIER -70.64 -46.55 63.07 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.006 0.431 . . . . 0.0 110.326 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.672 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 6.2 tt -54.28 -27.53 35.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.971 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.89 -51.93 5.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.362 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.1 t -64.23 -33.91 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.797 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.551 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 12.7 mmtp -78.93 -30.21 44.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.482 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.816 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -69.78 -50.42 49.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -57.32 -39.23 75.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.411 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -73.04 -29.47 63.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.869 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -71.54 -23.16 61.72 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.851 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.703 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.8 t -65.0 -48.65 83.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.588 0 CA-C-O 121.297 0.57 . . . . 0.0 109.687 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.15 -26.73 63.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.546 177.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 10.4 t -84.61 -30.69 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.792 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.741 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.91 -39.57 61.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.797 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.438 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 1.5 mm100 -65.52 -31.03 71.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.152 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.617 ' HB1' ' HG2' ' A' ' 128' ' ' LYS . . . -78.91 -48.75 14.01 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.177 179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.489 ' HA ' ' HB3' ' A' ' 130' ' ' ALA . 2.5 t-80 -67.63 -22.39 65.33 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.554 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -87.62 -45.0 10.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.285 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.29 -45.25 7.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.803 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.634 ' HG3' ' N ' ' A' ' 130' ' ' ALA . 1.3 ptpt -95.86 178.51 5.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.526 0.679 . . . . 0.0 111.366 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.565 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 2.3 tt0 -90.04 46.87 1.39 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.076 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.634 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.13 -15.18 8.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.686 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.38 -88.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.271 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -76.26 126.95 31.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.003 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -80.89 -46.07 15.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.856 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -79.22 110.08 14.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.006 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.3 m -104.0 158.74 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.449 ' HB3' ' H ' ' A' ' 137' ' ' SER . 2.7 m120 -87.61 -157.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.449 ' H ' ' HB3' ' A' ' 136' ' ' ASN . 0.0 OUTLIER -82.67 58.7 4.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.98 0.419 . . . . 0.0 110.979 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.23 -173.32 3.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.067 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.71 100.18 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -100.26 -41.61 2.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.436 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 m -101.85 142.59 24.91 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.693 0.282 . . . . 0.0 111.025 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.47 168.66 3.74 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.628 2.219 . . . . 0.0 112.346 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.29 141.39 28.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.869 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.2 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.123 -179.963 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.121 0 CA-C-O 120.147 -0.252 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.14 -34.42 13.33 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.512 2.141 . . . . 0.0 112.264 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 mt -87.88 151.73 22.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.077 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.94 -130.45 4.2 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.425 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.7 t -104.97 102.89 12.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.819 0.342 . . . . 0.0 110.87 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -145.8 86.45 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.144 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.75 -77.84 0.48 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.002 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 55.02 35.65 25.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.187 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.51 21.8 8.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.208 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.439 ' H ' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -93.0 -49.99 0.28 Allowed Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.282 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.439 ' HD2' ' H ' ' A' ' 10' ' ' THR . 90.0 Cg_endo -78.5 76.71 4.32 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.094 1.863 . . . . 0.0 112.287 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.78 -3.82 57.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.181 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 p -101.42 148.89 6.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.067 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -69.83 123.98 22.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.687 179.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 t -100.9 150.31 22.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.14 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.607 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 5.7 t -101.2 -51.31 0.17 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.536 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.607 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 50.0 Cg_exo -56.5 -39.53 90.68 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.182 1.921 . . . . 0.0 112.302 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -85.93 93.23 8.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.792 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -75.63 161.82 28.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 tppp? -74.86 115.8 14.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.908 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -0.38 27.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.523 ' H ' ' HG3' ' A' ' 20' ' ' LYS . . . -92.65 48.24 1.36 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.032 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.26 166.31 6.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.083 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.06 49.61 1.23 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.544 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 m -94.95 64.44 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.972 0.415 . . . . 0.0 110.902 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.87 37.23 0.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.943 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.537 ' HB3' ' HD3' ' A' ' 28' ' ' PRO . 10.4 t-20 -87.25 -51.86 0.42 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.305 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' A' ' 27' ' ' ASN . 87.1 Cg_endo -81.3 83.9 2.07 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.192 1.928 . . . . 0.0 112.424 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.49 98.79 11.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.886 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -96.11 -68.41 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.063 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 56.5 33.81 23.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.924 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.08 75.56 2.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.911 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -107.62 100.58 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.927 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.04 171.63 11.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.127 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.774 ' H ' ' HA ' ' A' ' 36' ' ' PRO . 0.1 OUTLIER -93.59 -50.12 0.27 Allowed Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.68 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.774 ' HA ' ' H ' ' A' ' 35' ' ' GLN . 65.9 Cg_endo -91.93 172.87 20.63 Favored 'Cis proline' 0 C--N 1.356 0.94 0 C-N-CA 124.723 -0.949 . . . . 0.0 112.579 0.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -81.3 115.38 20.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.812 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 t -100.93 -0.94 10.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.15 137.05 33.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.3 ttt -103.55 -18.27 14.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.179 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.44 158.53 23.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.986 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.414 ' HA ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 61.32 108.26 0.03 OUTLIER Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.142 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 42' ' ' GLN . 37.4 Cg_endo -65.44 155.54 68.21 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.518 2.145 . . . . 0.0 112.265 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -87.58 -177.08 5.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.068 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -101.16 128.52 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.086 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -108.31 -26.24 10.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 22.4 t -102.32 132.4 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.012 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -87.37 -25.48 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.013 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -88.12 89.41 1.6 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.58 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.26 131.2 45.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 110.889 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -85.65 136.3 37.19 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.008 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -81.89 -165.15 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.691 2.261 . . . . 0.0 112.576 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.707 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -90.5 154.69 19.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.833 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.784 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -171.29 -169.25 0.71 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.91 179.143 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 1.022 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.59 -30.85 61.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.631 0.253 . . . . 0.0 111.297 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.2 m -67.23 -49.89 62.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.608 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -59.28 -39.92 84.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.212 0.529 . . . . 0.0 110.212 178.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.022 HD12 ' HA ' ' A' ' 55' ' ' ALA . 12.5 mt -62.7 -45.5 92.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.634 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -15.03 58.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.912 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.3 t -75.29 -10.34 59.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.696 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.2 125.54 18.96 Favored Pre-proline 0 N--CA 1.449 -0.52 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.514 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.539 ' O ' ' N ' ' A' ' 64' ' ' GLN . 42.9 Cg_exo -54.96 -165.63 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.739 2.293 . . . . 0.0 110.643 177.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.409 ' CD ' ' CB ' ' A' ' 62' ' ' PRO . 86.8 Cg_exo -43.03 -15.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.359 1.119 0 C-N-CA 121.796 1.664 . . . . 0.0 112.199 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.62 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 0.4 OUTLIER -40.0 -83.16 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.631 177.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.62 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 1.6 mm-40 -107.17 -1.19 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.281 -179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -55.08 -35.59 64.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.984 0.421 . . . . 0.0 110.549 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.585 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -115.92 29.87 7.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.586 179.376 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.589 ' HB2' ' HA ' ' A' ' 65' ' ' GLU . 10.0 mm-40 -137.57 -57.44 0.69 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.544 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.4 OUTLIER -74.45 -8.44 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.902 -178.683 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -58.49 -40.73 83.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.679 0.276 . . . . 0.0 111.34 -179.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.967 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.72 27.94 3.02 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.451 -0.88 . . . . 0.0 112.579 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -141.2 -0.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -130.08 -22.62 2.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.642 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.698 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -72.9 -21.29 60.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.319 178.467 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.544 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -38.29 -57.15 1.89 Allowed Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.533 -178.12 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 55.5 Cg_endo -69.76 -20.31 35.0 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.982 1.788 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.645 HD12 ' HB2' ' A' ' 53' ' ' LEU . 65.7 mt -88.75 -19.49 25.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.631 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.698 HG12 ' O ' ' A' ' 74' ' ' LEU . 13.3 mm -73.85 -38.21 49.89 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.659 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 2.3 mt-30 -53.84 -16.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.923 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.85 -38.47 28.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.973 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.692 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.22 -46.07 57.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.103 0.477 . . . . 0.0 110.715 -179.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -111.88 159.15 34.54 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.762 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.768 ' HG2' HD23 ' A' ' 85' ' ' LEU . 36.4 Cg_endo -64.49 75.86 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.264 1.976 . . . . 0.0 111.871 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.659 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.6 OUTLIER 46.52 38.91 6.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.005 -178.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.9 OUTLIER -93.83 4.27 54.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.015 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.48 62.91 1.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.178 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -96.6 -8.05 57.52 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 92' ' ' MET . 1.5 tptt -177.48 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.891 -0.655 . . . . 0.0 110.158 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.824 HG21 HG13 ' A' ' 115' ' ' VAL . 68.1 mt -79.94 -88.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.359 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.967 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -52.7 -39.98 62.51 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.522 0.201 . . . . 0.0 111.014 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.17 -29.56 52.65 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.582 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.729 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.7 ttp -76.75 -33.66 58.1 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.107 -0.547 . . . . 0.0 109.988 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.47 -5.22 0.75 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.702 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.715 HD21 HD13 ' A' ' 70' ' ' LEU . 2.1 mm? -110.3 27.33 9.73 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -170.57 3.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.018 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.913 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -150.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.338 0.59 . . . . 0.0 111.512 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.567 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.4 t70 -59.52 -3.01 0.39 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.192 177.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.575 ' H ' HG12 ' A' ' 96' ' ' ILE . 15.4 m120 78.66 -29.72 0.15 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.48 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -32.94 65.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.44 . . . . 0.0 109.938 178.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.913 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -74.16 -23.83 59.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.876 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.435 ' CB ' HD11 ' A' ' 96' ' ' ILE . 0.2 OUTLIER -75.18 -24.7 57.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.892 177.168 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.2 mp -90.2 -45.02 9.37 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.324 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -37.13 82.35 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.936 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.612 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -59.61 -35.87 75.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.285 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 58' ' ' LEU . 15.5 mt -87.1 -9.07 56.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.07 0.462 . . . . 0.0 110.058 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -108.93 -5.05 16.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.399 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.855 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.7 OUTLIER -148.54 129.52 7.04 Favored Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.673 -179.411 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 21.9 Cg_exo -66.18 0.48 3.24 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.849 2.366 . . . . 0.0 112.555 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -126.31 -19.93 4.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.784 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.855 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -64.03 -47.94 78.27 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.325 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.784 ' HB3' HG22 ' A' ' 54' ' ' THR . 3.8 tt -50.39 -22.86 2.04 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.769 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -94.16 -62.87 1.26 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.196 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 8.0 t -50.23 -29.42 9.43 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.58 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 14.2 mmtp -81.18 -43.1 19.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.666 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.824 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -64.58 -58.2 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.265 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.431 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -51.02 -41.11 59.6 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.886 0.374 . . . . 0.0 110.83 178.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 113' ' ' SER . 12.5 mt-10 -71.68 -32.83 68.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.219 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.74 -23.05 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.037 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.2 t -65.28 -47.97 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 109.676 176.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.55 -27.68 64.79 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.482 177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.3 t -83.54 -32.42 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.693 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.83 -41.06 65.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.173 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.484 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.3 mm100 -61.74 -36.63 81.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.017 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.51 ' C ' ' HG2' ' A' ' 128' ' ' LYS . . . -70.65 -78.4 0.08 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.595 177.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.488 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.9 OUTLIER -29.61 -39.25 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.866 0.729 . . . . 0.0 112.555 -177.761 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 124' ' ' ALA . 14.4 mm100 -61.34 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.305 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.57 28.26 3.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.791 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.6 OUTLIER -95.98 -162.71 0.98 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.235 0.54 . . . . 0.0 111.173 179.265 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -88.08 26.81 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.697 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.791 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -59.25 -76.16 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.908 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -91.99 -166.21 1.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.916 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -77.37 162.7 27.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.61 106.94 5.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.864 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.59 -164.75 1.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.039 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.0 p -73.96 -17.0 17.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -84.65 33.34 0.52 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.68 134.18 34.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.934 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.85 -172.15 0.97 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.998 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.5 t -95.78 63.83 2.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.856 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -96.08 103.98 3.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.522 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 17.9 m -83.6 140.13 41.18 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.561 0.22 . . . . 0.0 111.122 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.87 140.32 58.21 Favored 'Cis proline' 0 C--N 1.348 0.507 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.371 0.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 m -99.75 110.45 22.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.808 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.101 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 120.218 -0.212 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.55 121.45 9.99 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.704 2.27 . . . . 0.0 112.165 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.89 -33.69 26.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.925 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.11 42.71 2.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 78.9 p -81.23 -51.59 8.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.75 0.31 . . . . 0.0 110.893 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.23 87.49 2.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.081 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.13 28.31 1.71 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.108 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 163.48 9.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.68 170.05 2.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.096 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 4.9 m 60.27 100.79 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.174 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.944 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 10' ' ' THR . 72.7 Cg_endo -76.34 154.17 97.65 Favored 'Cis proline' 0 C--N 1.35 0.624 0 C-N-CA 123.538 -1.443 . . . . 0.0 112.468 0.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.32 -52.78 4.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.063 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -107.61 174.48 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.135 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -49.67 9.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.42 152.34 20.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.955 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 43.9 t -99.26 127.08 35.66 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 20.4 Cg_exo -66.39 -148.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.739 2.293 . . . . 0.0 112.139 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -70.75 150.26 46.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.746 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -59.9 139.84 57.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.065 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -162.64 0.82 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 91.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.884 0.373 . . . . 0.0 110.85 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.05 93.87 9.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.992 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.51 122.59 23.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.04 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.35 80.97 1.36 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.587 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -101.64 -13.99 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.92 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -12.09 53.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.842 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -93.82 123.06 60.78 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.861 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -60.51 92.46 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.591 2.194 . . . . 0.0 112.17 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -94.33 153.38 18.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.854 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -75.15 -177.19 3.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.97 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -140.17 31.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 33' ' ' ASN . 0.5 OUTLIER -72.82 -28.97 62.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.035 -179.734 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.436 ' N ' ' HG ' ' A' ' 32' ' ' LEU . 26.8 m120 -102.73 31.69 4.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.78 -3.56 58.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.023 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -77.82 124.42 86.31 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 153.65 77.26 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.466 2.11 . . . . 0.0 112.165 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.756 ' HB3' ' HB2' ' A' ' 40' ' ' MET . 2.2 mp0 -93.7 96.7 9.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.92 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.98 -27.26 6.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.019 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -80.69 -10.75 59.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.895 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.756 ' HB2' ' HB3' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -91.14 96.14 10.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.978 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -97.55 86.95 3.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.808 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.96 98.23 3.16 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.42 94.66 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.568 2.179 . . . . 0.0 112.287 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.68 150.32 34.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.109 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.454 HG11 ' HB1' ' A' ' 80' ' ' ALA . 14.7 m -93.24 25.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -102.14 -29.46 11.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.066 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.64 -176.94 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.075 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -95.14 38.92 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.64 -77.6 1.38 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.536 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.45 110.85 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.819 0.342 . . . . 0.0 110.915 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.71 114.09 58.46 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.893 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.14 163.33 8.06 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.626 2.218 . . . . 0.0 112.449 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.717 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -85.77 152.51 22.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.998 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.881 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.08 -175.56 4.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.186 179.019 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 1.001 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.94 -32.68 47.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.342 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.3 m -67.19 -49.05 66.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.602 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.643 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -59.22 -37.04 76.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.318 0.58 . . . . 0.0 110.154 178.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.001 HD12 ' HA ' ' A' ' 55' ' ' ALA . 16.3 mt -64.51 -44.31 91.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.563 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.25 -10.4 41.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.577 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -75.37 -2.92 30.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -131.39 110.39 15.07 Favored Pre-proline 0 N--CA 1.452 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.831 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.557 ' O ' ' N ' ' A' ' 64' ' ' GLN . 45.4 Cg_exo -55.62 -160.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.191 2.594 . . . . 0.0 110.891 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 62' ' ' PRO . 73.8 Cg_exo -42.56 -12.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 122.005 1.803 . . . . 0.0 113.138 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 62' ' ' PRO . 25.4 mm100 -42.7 -85.62 0.0 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.04 0.448 . . . . 0.0 110.58 176.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.762 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -107.09 -78.97 0.58 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.976 177.773 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER 56.59 -72.44 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.904 0.752 . . . . 0.0 110.658 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.641 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -89.94 19.52 4.82 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.319 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.762 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 3.2 mm100 -116.91 -38.44 3.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.355 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.633 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 33.5 mtm -80.76 -7.73 59.47 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.894 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -60.71 -35.64 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -178.558 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -143.01 28.26 2.13 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.096 -1.05 . . . . 0.0 112.988 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -139.27 -6.53 1.38 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.778 0.323 . . . . 0.0 111.16 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.527 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.0 tmt_? -127.68 -19.48 4.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.132 0.491 . . . . 0.0 109.898 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.59 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -77.78 -26.35 49.69 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.76 178.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.536 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -38.75 -52.71 3.57 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.316 -177.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 14.2 Cg_exo -71.17 -22.78 25.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.289 1.993 . . . . 0.0 112.819 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.717 HD12 ' HB2' ' A' ' 53' ' ' LEU . 58.4 mt -88.02 -23.17 23.87 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.765 HG13 ' HB ' ' A' ' 90' ' ' THR . 5.6 mm -72.16 -37.49 59.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 110.413 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.848 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.7 mt-30 -54.2 -14.75 1.22 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.283 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.454 ' HB1' HG11 ' A' ' 45' ' ' VAL . . . -84.12 -36.66 22.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.843 178.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.47 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.43 -35.27 68.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.015 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.694 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.2 m-70 -121.91 162.09 38.86 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 -179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.07 72.3 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.625 2.217 . . . . 0.0 111.948 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.848 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 51.11 24.76 2.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.287 -179.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 9.1 mt -85.39 5.15 32.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.936 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.699 ' HB3' ' HG3' ' A' ' 79' ' ' GLN . . . -83.01 47.55 1.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.259 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -91.76 12.47 69.33 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.004 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.934 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 5.1 ttpt -177.58 -13.51 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.832 HG21 HG13 ' A' ' 115' ' ' VAL . 36.7 mt -49.85 -82.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -53.49 -38.12 63.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.509 0.195 . . . . 0.0 110.786 -178.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.65 -28.85 65.95 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.48 176.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.934 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.5 ttm -75.85 -38.24 58.19 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.458 0.647 . . . . 0.0 109.885 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.674 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.5 mm? -54.7 -9.55 0.35 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.486 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.894 HD11 HD13 ' A' ' 70' ' ' LEU . 5.0 mp -105.74 28.55 7.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.431 ' H ' ' H ' ' A' ' 96' ' ' ILE . 9.8 pt-20 -172.43 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.407 -178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.987 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -63.32 -150.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.323 0.583 . . . . 0.0 111.734 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -57.72 -5.7 0.42 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.858 177.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.559 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-20 79.62 -25.63 0.18 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.236 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.4 50.78 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.987 ' HB2' HG13 ' A' ' 96' ' ' ILE . 3.9 mt-10 -76.07 -24.28 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.776 177.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.707 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -75.2 -26.03 58.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.023 177.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 mp -90.72 -44.95 9.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.038 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.53 -41.65 96.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.04 -178.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.787 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.0 ptm -56.75 -37.5 71.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.812 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.842 HD23 HD13 ' A' ' 58' ' ' LEU . 56.5 mt -80.44 -11.61 59.66 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.232 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -4.4 14.38 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.761 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -144.2 134.65 12.08 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.164 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.574 ' O ' HG21 ' A' ' 54' ' ' THR . 7.8 Cg_exo -72.92 3.55 4.37 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.984 2.456 . . . . 0.0 111.671 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 113' ' ' SER . 28.5 mt-10 -126.15 -14.41 6.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.656 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.761 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -76.28 -47.21 24.57 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.002 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.881 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.78 -40.4 13.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.429 176.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 112' ' ' ARG . 0.3 OUTLIER -81.88 -65.53 1.0 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.573 -179.44 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.513 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -47.43 -49.72 24.52 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -178.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.5 mmtp -64.24 -30.96 71.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.193 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.832 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.78 -56.48 10.64 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.068 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.123 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.414 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -54.91 -35.68 64.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.021 0.438 . . . . 0.0 110.408 178.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.97 -32.05 61.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.088 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.623 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.4 -28.99 67.58 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.835 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.694 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.7 t -59.68 -49.02 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.158 0.504 . . . . 0.0 109.787 177.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -56.37 -25.92 51.21 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.701 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 9.9 t -86.64 -30.77 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.846 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.719 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.09 -41.02 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.996 179.275 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.481 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 15.1 mm100 -65.27 -35.06 79.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.004 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -72.16 -76.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.52 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.714 ' HA ' ' HE3' ' A' ' 128' ' ' LYS . 0.4 OUTLIER -31.73 -35.22 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.658 0.599 . . . . 0.0 112.142 -178.614 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 124' ' ' ALA . 88.3 mm-40 -70.14 -78.71 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.113 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.73 32.34 2.1 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.747 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.1 OUTLIER -96.4 -156.41 0.53 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.117 0.484 . . . . 0.0 110.83 178.738 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -87.24 23.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.747 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.2 -28.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.181 -178.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.02 -43.64 52.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -83.26 97.44 8.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -89.5 -46.02 8.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.78 167.43 18.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.6 t -89.54 107.85 18.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.67 -18.88 65.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.82 87.97 5.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.885 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.01 122.99 30.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 138.57 42.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.869 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -79.09 -101.01 0.23 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.487 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 23.7 m -77.55 143.94 68.92 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 0.0 111.15 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.98 140.26 93.31 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.619 2.213 . . . . 0.0 112.282 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 80.8 p -93.15 -8.04 43.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.164 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.68 -37.18 22.25 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.514 2.142 . . . . 0.0 112.22 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.7 174.79 6.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.983 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.23 25.75 9.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.587 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.2 p -96.85 -25.76 15.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.301 . . . . 0.0 110.94 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.47 174.59 7.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -81.89 -164.54 0.81 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.105 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.35 53.17 9.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.134 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -144.9 -68.21 0.31 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -166.0 134.7 2.46 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.71 16.1 1.35 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.638 2.225 . . . . 0.0 112.499 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.2 63.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.235 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 m -89.84 12.04 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.139 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -96.22 89.98 5.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.858 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 p -97.14 -173.95 2.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.912 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 98.49 47.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.139 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -76.27 -41.01 0.52 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.61 2.207 . . . . 0.0 112.366 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -96.15 -173.76 2.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.066 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.61 -167.83 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.039 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.34 14.4 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.963 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -89.21 86.14 6.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.8 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.84 -64.42 1.15 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.09 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 160.56 21.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.069 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.98 -2.46 58.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.594 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.9 p -82.33 140.58 16.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 110.943 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 -81.51 -177.18 6.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.877 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 62.9 m-80 -88.09 108.83 23.64 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 27' ' ' ASN . 35.0 Cg_endo -65.25 -76.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.455 2.104 . . . . 0.0 112.359 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -89.58 115.34 26.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -97.92 178.88 4.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.011 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -123.36 27.26 7.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.815 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.68 169.53 10.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -98.26 84.68 3.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.823 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.58 35.62 1.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.67 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 43.3 mm-40 -83.29 -51.96 0.64 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.184 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.67 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 16.6 Cg_exo -67.91 -12.41 35.22 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 122.269 1.98 . . . . 0.0 112.085 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.47 107.51 19.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.019 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -98.61 132.52 43.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.3 t -85.03 136.97 33.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.997 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.9 mtp -103.47 123.16 46.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.958 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 56.35 83.08 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.057 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.89 88.32 4.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.914 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -56.25 102.73 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.618 2.212 . . . . 0.0 112.303 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.03 78.2 6.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.975 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 m -92.66 170.1 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.198 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -86.82 60.33 6.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.826 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.7 p -93.83 142.18 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.023 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -81.65 127.76 33.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -92.68 27.73 10.4 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.535 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -109.11 72.61 0.82 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.888 0.375 . . . . 0.0 110.999 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -84.24 121.83 75.44 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.851 179.886 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.23 -175.56 1.8 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.476 2.117 . . . . 0.0 112.477 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -80.74 148.17 30.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.022 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -164.94 -174.95 3.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.585 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.51 -31.14 14.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.61 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -67.96 -46.85 70.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.865 0.364 . . . . 0.0 110.473 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.822 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.13 -38.12 75.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.787 178.373 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.641 ' HG ' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -64.71 -43.52 93.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 178.159 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.488 ' O ' ' HD3' ' A' ' 62' ' ' PRO . . . -70.89 -2.07 13.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.088 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 57' ' ' MET . 74.5 m -86.0 -8.5 57.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.886 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.659 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.69 53.03 9.28 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.74 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 1.1 Cg_endo -49.43 -49.69 14.97 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.517 2.144 . . . . 0.0 113.568 -178.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.667 ' HD3' ' HG2' ' A' ' 62' ' ' PRO . 55.2 Cg_endo -96.87 4.3 1.71 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.476 2.117 . . . . 0.0 112.81 -178.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.423 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -113.27 -97.26 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.494 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.727 ' HB2' ' HG3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.05 45.18 1.0 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.294 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.74 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 2.9 tt0 -62.08 -31.56 72.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.7 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -123.14 37.56 4.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.935 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.691 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 6.4 tt0 -128.19 -50.26 1.31 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.679 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.727 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 15.4 mtm -74.46 10.17 1.43 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 111.726 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 1.058 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.57 -62.34 1.56 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.58 0.705 . . . . 0.0 110.391 -179.562 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.012 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -114.66 16.6 18.86 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 112.393 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.54 -8.18 4.63 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HB3' ' HB3' ' A' ' 69' ' ' MET . 0.0 OUTLIER -125.97 -17.56 5.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.005 0.431 . . . . 0.0 110.816 -179.582 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.646 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.09 -10.98 59.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.633 -179.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.473 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 10.4 t80 -49.13 -54.04 32.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.771 -178.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.511 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 44.0 Cg_endo -67.29 -13.61 40.04 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.031 1.821 . . . . 0.0 112.079 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.821 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.0 mm? -86.39 -42.63 13.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.299 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.809 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.3 mm -60.95 -40.5 85.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.851 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -47.81 -20.45 0.3 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.024 -179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.21 -42.4 15.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.852 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.485 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -68.78 -39.98 79.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.62 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.886 ' CE1' HG21 ' A' ' 119' ' ' VAL . 6.2 m170 -123.5 155.82 65.13 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.932 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.49 ' HD2' HD12 ' A' ' 85' ' ' LEU . 24.6 Cg_exo -63.21 77.22 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 0.0 111.958 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.873 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.6 t 41.36 30.06 0.12 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.719 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.49 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.7 OUTLIER -85.41 8.38 19.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.779 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.809 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -69.56 12.55 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.874 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -52.95 -22.22 11.96 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.049 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.724 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -161.34 26.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.907 0.384 . . . . 0.0 111.275 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.872 HG21 HG13 ' A' ' 115' ' ' VAL . 62.8 mt -80.77 -87.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.199 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.012 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.91 -39.31 58.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.224 -179.42 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.15 -31.38 61.94 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.033 -1.08 . . . . 0.0 110.632 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.724 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.9 ttp -74.9 -34.31 62.16 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.081 -0.559 . . . . 0.0 110.083 177.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.685 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -58.37 -7.12 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.249 -177.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.058 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.6 mp -111.62 29.06 8.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 176.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 11.0 pt-20 -167.99 0.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.038 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 1.006 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.73 -148.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.488 0.661 . . . . 0.0 111.382 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -57.74 -6.29 0.5 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.7 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.741 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 78.57 -31.58 0.15 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.276 -179.302 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.52 -29.69 69.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.885 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 1.006 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -74.86 -35.52 62.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.107 177.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.631 ' HG ' HD12 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -65.32 -30.04 70.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.03 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.631 HD12 ' HG ' ' A' ' 101' ' ' LEU . 5.4 mp -81.79 -47.65 12.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.352 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -43.64 92.01 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.529 -177.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.827 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -55.92 -34.16 65.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.625 -179.078 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.663 HD21 ' HB3' ' A' ' 70' ' ' LEU . 21.2 mt -86.25 -11.4 52.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.841 0.353 . . . . 0.0 110.933 -179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.24 -6.52 17.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -177.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.774 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.37 139.12 16.16 Favored Pre-proline 0 C--N 1.332 -0.184 0 C-N-CA 120.454 -0.498 . . . . 0.0 112.153 -178.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.573 ' O ' HG21 ' A' ' 54' ' ' THR . 72.1 Cg_endo -75.78 2.81 6.6 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.606 2.204 . . . . 0.0 111.778 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -125.52 -12.95 6.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.345 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.69 -46.22 19.57 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 177.585 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.46 -40.62 18.69 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.393 176.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -79.32 -61.42 2.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.359 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 28.7 t -50.21 -53.13 30.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -178.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 3.7 mmtp -60.11 -29.8 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.373 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.872 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -72.91 -62.14 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.092 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 7.7 t0 -49.23 -35.12 16.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.995 0.426 . . . . 0.0 110.749 178.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -43.53 61.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.448 178.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.31 65.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.998 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.886 HG21 ' CE1' ' A' ' 82' ' ' HIS . 57.9 t -65.35 -45.88 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.688 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.87 -27.34 65.08 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.428 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.499 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 22.4 t -83.07 -33.2 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.477 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.448 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.41 -38.95 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.959 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -67.48 -28.69 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.019 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.92 -8.85 53.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.204 179.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.703 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.1 OUTLIER -121.68 8.5 10.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.751 -178.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.434 ' HB3' ' H ' ' A' ' 127' ' ' ALA . 4.9 mm-40 -74.17 -109.91 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.417 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.434 ' H ' ' HB3' ' A' ' 126' ' ' GLN . . . -95.55 33.24 1.65 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 110.905 179.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.09 -143.0 0.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.025 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.27 15.43 4.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.106 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.703 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -62.99 -37.56 87.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -74.79 127.15 32.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -77.0 95.16 4.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.971 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -82.56 -13.4 56.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.898 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.26 157.32 37.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.032 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 21.4 m -79.09 -170.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -68.16 90.45 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.907 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.6 m -103.5 91.58 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.009 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -76.44 82.17 3.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.981 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.67 92.8 9.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.56 -62.42 1.04 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.41 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.804 ' H ' ' HA ' ' A' ' 142' ' ' PRO . 17.2 t -95.6 -47.93 0.26 Allowed Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.804 ' HA ' ' H ' ' A' ' 141' ' ' VAL . 93.6 Cg_endo -88.97 -46.78 0.17 OUTLIER 'Cis proline' 0 C--N 1.356 0.961 0 C-N-CA 124.566 -1.014 . . . . 0.0 112.857 1.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.8 p -102.65 168.08 9.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.209 -0.9 . . . . 0.0 111.022 -179.975 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.158 0 N-CA-C 112.442 -0.263 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -56.53 -29.07 77.04 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.585 2.19 . . . . 0.0 112.304 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tp -97.05 125.92 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.874 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.18 152.73 24.74 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.62 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -98.14 101.45 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.767 0.318 . . . . 0.0 110.833 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.22 76.15 0.31 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.088 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.42 101.9 11.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.263 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.42 -161.08 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.17 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.32 53.85 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.117 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.7 m -145.99 127.19 7.43 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.807 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.35 -177.74 20.89 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.362 0.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.63 -18.4 54.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.141 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -93.06 137.19 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.188 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -99.83 -26.45 14.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.798 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t -106.07 69.97 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.866 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.4 p -99.39 130.7 26.42 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.87 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.5 111.55 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.499 2.133 . . . . 0.0 112.25 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -83.17 126.07 32.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -72.92 -175.84 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.917 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -88.99 23.86 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.912 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -88.69 -31.15 18.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.955 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.88 14.77 24.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.05 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.43 109.57 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.38 25.02 28.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.03 55.45 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.958 0.409 . . . . 0.0 111.114 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.02 -34.79 50.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.894 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -80.46 151.54 72.03 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.043 -179.62 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.451 ' O ' ' HA ' ' A' ' 27' ' ' ASN . 3.0 Cg_exo -76.23 -77.13 0.0 OUTLIER 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.868 -1.305 . . . . 0.0 112.281 0.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -94.44 -106.56 0.13 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.694 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -100.43 161.15 13.79 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.705 0.288 . . . . 0.0 110.875 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -87.72 8.92 23.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.921 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.27 143.53 36.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.954 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -93.74 133.96 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.987 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.75 28.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.994 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -98.67 104.17 23.02 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.854 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.08 -18.78 18.28 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.519 2.146 . . . . 0.0 112.331 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.24 172.22 13.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.799 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -101.56 95.13 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.098 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.44 82.23 2.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.939 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.31 94.0 6.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.852 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.72 129.63 35.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.093 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -155.21 97.85 2.4 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.57 94.58 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.596 2.197 . . . . 0.0 112.272 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -89.02 58.2 4.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.8 t -81.91 -56.26 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.342 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.64 170.31 9.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.99 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.72 103.72 13.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.923 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -91.89 -85.79 0.24 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.35 120.63 6.57 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.579 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.475 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -94.39 172.79 7.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.796 0.331 . . . . 0.0 110.707 179.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -91.07 105.69 13.3 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 96.1 Cg_endo -80.64 170.87 15.23 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.569 2.179 . . . . 0.0 112.247 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.723 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -97.58 148.91 22.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.789 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.69 -163.29 0.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.451 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -57.84 -40.24 79.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.447 -179.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 63.2 m -58.69 -45.69 88.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.871 0.367 . . . . 0.0 110.533 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.723 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.83 -42.2 97.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.28 178.687 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -58.21 -47.29 83.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.57 178.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.67 -10.35 51.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.326 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 57' ' ' MET . 41.5 t -82.45 -7.1 59.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.022 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.856 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -134.34 55.96 16.72 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.58 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.506 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 52.7 Cg_exo -55.19 -50.15 14.01 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.423 2.082 . . . . 0.0 113.288 -179.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.505 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.5 Cg_endo -87.45 -7.63 6.63 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 122.209 1.94 . . . . 0.0 112.715 -179.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.856 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 3.8 tp-100 -95.41 -83.56 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.655 ' HB3' ' HB2' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -104.92 -87.31 0.45 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.206 -179.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.473 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 1.6 mt-30 73.09 -62.64 0.46 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.513 -178.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -111.8 24.06 13.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.86 178.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.655 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 1.6 mt-30 -118.62 -53.88 2.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.357 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.574 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 4.4 ptt? -81.08 3.82 22.0 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.843 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.21 -42.44 93.5 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.048 179.7 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.042 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.22 34.48 2.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.327 -0.939 . . . . 0.0 112.83 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.51 -3.43 0.72 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.959 0.409 . . . . 0.0 111.196 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.454 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -128.48 -21.56 3.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.117 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -76.59 -18.71 58.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.365 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -44.61 -56.14 9.0 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.97 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 60.0 Cg_endo -71.76 -8.96 24.1 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.054 1.836 . . . . 0.0 112.092 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.516 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 73.2 mt -97.34 -24.32 15.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.397 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -69.56 -36.91 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 177.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.5 mt-30 -51.6 -15.63 0.49 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.364 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -81.77 -42.61 19.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.611 178.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.697 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.75 -30.63 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.374 179.21 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.676 ' CE1' HG21 ' A' ' 119' ' ' VAL . 15.1 m170 -124.73 156.89 67.67 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.848 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.523 ' HD2' HD12 ' A' ' 85' ' ' LEU . 12.4 Cg_exo -67.7 73.86 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.297 1.998 . . . . 0.0 110.465 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.845 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.3 t 45.0 34.06 1.17 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.112 -177.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.523 HD12 ' HD2' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -84.73 2.6 41.25 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.329 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -77.07 60.89 1.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.81 -8.94 61.58 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 177.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.694 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.4 ttpt -176.49 30.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.14 -0.53 . . . . 0.0 110.54 179.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.813 HG21 HG13 ' A' ' 115' ' ' VAL . 64.2 mt -80.2 -90.81 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.323 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.042 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.48 -42.8 55.1 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.122 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.06 -32.7 50.13 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.304 -0.95 . . . . 0.0 111.137 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.725 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.08 -21.32 29.39 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 120.812 0.339 . . . . 0.0 110.405 179.175 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.659 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.0 mm? -61.48 -6.41 2.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.953 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.843 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -104.56 24.8 11.12 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.038 176.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 6.6 pt-20 -165.85 0.7 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.559 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.915 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.5 -153.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.519 0.676 . . . . 0.0 111.93 -179.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.445 ' N ' HG12 ' A' ' 96' ' ' ILE . 2.2 t70 -58.98 -3.92 0.41 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.17 177.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.84 -35.06 0.14 Allowed 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.156 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -66.14 -26.91 67.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.915 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -83.4 -24.68 31.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.503 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.2 tm? -74.86 -26.25 59.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.546 176.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.8 mp -88.75 -46.1 9.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.422 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -68.02 -36.25 79.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.644 -177.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.668 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 7.0 ptm -60.8 -34.92 75.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 110.941 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD23 ' A' ' 70' ' ' LEU . 27.5 mt -84.32 -13.77 51.51 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.799 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.67 -10.67 16.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.849 -177.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.829 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -139.37 131.88 15.33 Favored Pre-proline 0 C--N 1.33 -0.258 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.969 -178.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.597 ' O ' HG21 ' A' ' 54' ' ' THR . 7.1 Cg_exo -73.35 7.81 2.06 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.976 2.45 . . . . 0.0 111.859 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -127.59 -27.65 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.254 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.829 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.47 -49.26 74.34 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.789 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.8 tt -50.43 -32.9 19.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.31 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -59.32 2.34 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.379 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -57.28 -34.15 68.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.815 0.341 . . . . 0.0 111.175 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 20.0 mmtt -78.76 -29.2 45.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.354 179.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.813 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.46 -53.14 23.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.042 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.41 ' N ' HG12 ' A' ' 115' ' ' VAL . 22.8 t0 -56.85 -36.21 69.75 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.944 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -34.76 60.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.901 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.725 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -63.69 -29.94 71.1 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.446 177.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.676 HG21 ' CE1' ' A' ' 82' ' ' HIS . 23.6 t -55.46 -57.34 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.795 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.426 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -52.25 -24.51 7.44 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.416 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.518 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 10.7 t -87.02 -31.93 6.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.715 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.552 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -71.7 -43.12 66.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.918 178.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.552 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -67.06 -31.44 71.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.107 178.879 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.766 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -81.75 -12.16 58.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.205 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -119.26 8.12 11.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.247 -179.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -83.78 -99.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.955 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.61 23.62 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.604 0.24 . . . . 0.0 111.508 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.766 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 0.2 OUTLIER -86.62 -149.33 0.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.341 . . . . 0.0 111.185 -179.604 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -78.95 -3.79 46.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.704 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.6 -42.13 98.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.943 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -86.05 -13.54 47.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.79 -164.69 1.21 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.58 160.45 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.952 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -81.92 -53.5 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 4.8 m -93.95 128.44 45.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.011 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.78 -4.77 52.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.902 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.0 p -78.72 155.84 29.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.11 97.84 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.019 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 1.8 m -88.34 154.85 20.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.973 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -104.55 77.47 0.27 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.442 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 16.1 m -87.19 152.85 53.51 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.601 0.238 . . . . 0.0 111.014 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -62.65 174.23 3.04 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.562 2.175 . . . . 0.0 112.323 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 40.6 p -82.29 113.89 20.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.965 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.087 179.81 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.11 -22.21 54.75 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.588 2.192 . . . . 0.0 112.354 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.67 112.73 24.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.39 -8.59 57.43 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.602 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -104.96 128.83 53.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.933 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -114.13 91.93 3.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.111 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.29 170.5 8.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.062 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.46 158.84 30.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.071 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.87 170.05 10.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.6 p -71.5 138.98 83.67 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.054 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -79.22 154.09 89.68 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.504 -1.457 . . . . 0.0 112.395 -0.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.56 35.91 0.89 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.984 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 13.4 p -81.89 -22.15 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.065 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.41 116.25 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.9 p -111.74 131.66 55.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.874 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.403 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 3.4 p -98.64 130.56 27.64 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 31.3 Cg_exo -59.85 176.58 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.551 2.168 . . . . 0.0 112.276 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.26 135.53 33.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.945 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -73.67 -12.45 60.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.1 mttm -82.02 174.73 10.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -16.86 64.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.965 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.09 80.62 6.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.028 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.41 106.25 2.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.12 33.03 4.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.416 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 p -87.02 3.24 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.993 0.425 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -84.57 44.62 1.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.975 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -71.85 140.81 83.92 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.898 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.99 24.81 0.62 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.609 2.206 . . . . 0.0 112.497 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.15 32.29 0.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.976 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -76.89 -75.94 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.963 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.79 -18.6 6.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.007 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.59 122.25 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.871 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.418 ' H ' ' ND2' ' A' ' 33' ' ' ASN . 3.4 p30 -82.71 143.66 30.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.009 -179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.82 1.86 37.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.86 113.5 50.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.848 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.74 156.8 56.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.38 2.053 . . . . 0.0 112.442 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -80.29 172.64 13.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.06 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.43 HG22 ' HB2' ' A' ' 40' ' ' MET . 7.0 p -86.2 135.6 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.878 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.45 44.43 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.43 ' HB2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.46 -168.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.951 -179.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.0 93.85 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.84 83.92 0.22 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.21 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.96 124.57 14.71 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.524 2.149 . . . . 0.0 112.155 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 134.44 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.036 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 45' ' ' VAL . 5.5 p -98.16 78.15 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.293 0.568 . . . . 0.0 110.964 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -109.89 -56.01 2.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.694 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.619 HG22 ' H ' ' A' ' 49' ' ' GLY . 11.6 p -106.06 146.32 12.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -29.23 54.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.104 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.619 ' H ' HG22 ' A' ' 47' ' ' VAL . . . -100.58 95.26 1.4 Allowed Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.567 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.508 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.5 mt-30 -94.62 96.33 9.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -91.13 105.06 11.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.902 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 83.0 Cg_endo -80.88 -117.6 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.642 2.228 . . . . 0.0 112.295 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -69.09 135.34 50.62 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.881 0.372 . . . . 0.0 110.951 -179.852 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.888 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -170.96 -177.14 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.968 178.308 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 1.014 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.84 -34.43 27.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -48.36 64.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.917 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.469 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -57.89 -41.12 81.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.194 0.521 . . . . 0.0 110.043 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.014 HD12 ' HA ' ' A' ' 55' ' ' ALA . 6.6 mt -63.91 -44.44 92.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.595 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 62' ' ' PRO . . . -62.96 -9.84 11.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.002 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.7 m -84.15 -8.84 58.97 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.999 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.77 54.01 11.58 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.506 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.611 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 60.3 Cg_endo -102.89 120.65 0.06 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.106 2.537 . . . . 0.0 113.064 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 81.5 Cg_endo -98.62 32.33 10.58 Favored 'Cis proline' 0 N--CA 1.455 -0.761 0 C-N-CA 124.459 -1.059 . . . . 0.0 112.064 -0.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.637 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 2.9 tm0? -54.17 -89.54 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.462 -178.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.882 ' HG3' ' HG2' ' A' ' 69' ' ' MET . 1.8 pt-20 -107.81 20.07 19.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.748 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -53.06 -52.85 57.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.101 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -99.26 34.91 2.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.1 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 49.4 mm-40 -133.17 -49.84 0.87 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.145 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.882 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -79.49 -7.73 58.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.909 -178.652 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.885 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -60.95 -34.56 74.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.658 0.266 . . . . 0.0 111.477 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.98 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -138.61 28.69 2.64 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.798 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -137.62 -7.31 1.7 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.866 0.365 . . . . 0.0 111.139 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -19.98 4.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.217 0.532 . . . . 0.0 109.837 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.664 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.44 -31.41 48.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.65 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.526 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.27 -53.49 5.23 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.142 -177.355 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 42.9 Cg_endo -68.21 -21.42 42.0 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.951 1.768 . . . . 0.0 112.138 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.485 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 92.0 mt -88.61 -19.76 25.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.316 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.736 HG13 ' HB ' ' A' ' 90' ' ' THR . 20.8 mm -71.73 -35.99 57.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.91 0.386 . . . . 0.0 110.135 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.487 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.1 OUTLIER -53.35 -17.15 1.66 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.424 0.63 . . . . 0.0 109.895 177.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -81.08 -38.57 27.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.621 178.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.482 ' HE1' ' HA ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -69.8 -42.14 74.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.586 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.786 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.5 m-70 -122.25 152.0 59.89 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.953 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.652 ' HG2' HD12 ' A' ' 85' ' ' LEU . 19.8 Cg_endo -57.45 82.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.358 2.038 . . . . 0.0 111.565 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 14.1 t 40.16 37.63 0.42 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.416 -178.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -91.54 7.4 41.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.02 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.84 44.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.586 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.43 -11.64 84.94 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.536 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.639 ' O ' ' HB3' ' A' ' 92' ' ' MET . 1.2 tptt -175.57 32.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.851 HG21 HG13 ' A' ' 115' ' ' VAL . 70.7 mt -80.49 -89.44 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.026 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.98 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.17 -42.18 50.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.258 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.45 -31.44 57.12 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.078 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.639 ' HB3' ' O ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.96 -23.51 31.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 115.561 -0.319 . . . . 0.0 110.145 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.703 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.4 mm? -60.7 -9.06 3.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.403 178.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.885 HD11 HD13 ' A' ' 70' ' ' LEU . 4.8 mp -105.1 26.51 9.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.585 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 4.8 pt-20 -167.79 1.11 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.3 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.957 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.82 -154.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.486 0.66 . . . . 0.0 111.792 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.421 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.3 t0 -59.54 -2.82 0.38 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.201 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.537 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 78.79 -35.25 0.17 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.127 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -67.02 -25.82 66.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.89 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.957 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.9 mt-10 -84.18 -24.08 30.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.631 177.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.651 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.4 tp -74.82 -27.21 60.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.388 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -88.1 -47.86 8.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.091 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 99' ' ' SER . 0.1 OUTLIER -63.81 -40.9 97.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.53 -178.586 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.816 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.7 ptm -56.4 -39.03 72.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.562 0.22 . . . . 0.0 111.218 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.765 HD23 HD13 ' A' ' 58' ' ' LEU . 4.5 mt -85.82 -7.55 58.66 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.167 0.508 . . . . 0.0 110.284 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -109.38 -6.51 15.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.966 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.717 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -147.06 129.79 7.87 Favored Pre-proline 0 C--N 1.328 -0.348 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.691 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 16.9 Cg_exo -67.78 1.32 3.35 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.78 2.32 . . . . 0.0 112.055 179.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.4 -11.22 6.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.527 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.717 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.92 -45.51 23.85 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.888 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.2 OUTLIER -46.59 -41.12 14.03 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.482 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 2.4 ttt180 -79.29 -62.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.306 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.4 t -49.74 -54.34 19.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.342 . . . . 0.0 111.221 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.793 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 12.2 mmtt -58.88 -29.84 67.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.338 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.851 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -73.92 -55.45 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.076 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.46 -33.15 63.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.059 0.457 . . . . 0.0 110.594 178.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -39.24 50.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.551 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.37 66.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.821 177.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.786 HG11 ' ND1' ' A' ' 82' ' ' HIS . 15.6 t -66.82 -50.96 60.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.926 177.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.26 -24.96 58.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.655 177.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.57 -32.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.635 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -75.35 -36.61 60.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.077 179.331 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.78 -39.44 94.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -64.54 -79.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.41 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.817 ' HA ' ' HE3' ' A' ' 128' ' ' LYS . 1.6 t60 -33.16 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.72 0.638 . . . . 0.0 112.122 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 124' ' ' ALA . 11.5 mt-30 -73.74 -76.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.212 178.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.38 30.92 2.37 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.817 ' HE3' ' HA ' ' A' ' 125' ' ' HIS . 0.0 OUTLIER -96.49 -156.15 0.51 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.152 0.501 . . . . 0.0 110.838 178.703 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.31 21.24 2.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.23 176.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.71 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.44 -51.8 68.33 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.311 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -85.9 -162.61 0.76 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.086 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.5 -79.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.001 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -89.41 175.88 7.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.007 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.84 -28.17 65.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.003 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 5.0 t -76.88 147.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -82.08 148.16 28.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.9 t -99.85 161.57 13.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.795 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.612 ' HB3' HG13 ' A' ' 141' ' ' VAL . . . -70.98 -166.52 0.16 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.075 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.6 p -87.07 -72.01 0.53 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -89.63 72.22 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.365 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.612 HG13 ' HB3' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -95.62 104.82 17.32 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.552 0.215 . . . . 0.0 111.087 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -79.22 133.22 10.75 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 0.0 112.363 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 13.1 t -100.37 -15.58 17.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.716 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.006 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.122 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.36 137.9 31.8 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.58 2.187 . . . . 0.0 112.277 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.65 -23.02 16.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.44 75.12 2.35 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.496 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.5 m -85.86 80.78 8.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -128.92 179.61 5.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.022 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -92.03 89.11 6.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -164.39 105.69 0.87 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -151.79 -20.66 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.089 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.768 ' H ' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -154.3 -53.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.514 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.768 ' HD2' ' H ' ' A' ' 10' ' ' THR . 39.5 Cg_endo -66.02 -38.56 21.9 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.129 1.886 . . . . 0.0 112.161 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.5 69.28 9.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.052 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.739 HG22 ' H ' ' A' ' 15' ' ' THR . 11.7 p -82.56 147.9 5.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.048 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.4 ptt-85 -90.43 6.19 44.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.072 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.739 ' H ' HG22 ' A' ' 13' ' ' VAL . 17.1 p -102.81 159.97 15.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.936 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.59 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 7.0 t -98.39 -52.17 0.21 Allowed Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.634 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.59 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 60.9 Cg_endo -72.45 131.63 17.86 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.093 1.862 . . . . 0.0 112.391 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -82.96 162.53 21.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.964 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.32 -89.46 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.86 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 20' ' ' LYS . 2.7 ptmt -72.54 121.19 19.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.833 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -79.99 163.5 24.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.36 -55.83 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.23 124.18 27.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.018 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -21.33 64.64 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.57 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.7 t -106.13 135.24 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.117 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -95.82 160.83 14.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.24 144.42 92.27 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.921 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -66.96 91.2 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.543 2.162 . . . . 0.0 112.308 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -99.66 24.15 8.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.005 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -86.56 -91.06 0.1 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.902 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -169.37 -34.14 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.038 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 pp -69.62 155.78 39.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.993 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -98.17 86.5 3.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.63 90.99 6.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.045 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.53 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 29.0 mm100 -81.49 -51.35 0.87 Allowed Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.312 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 96.7 Cg_endo -79.49 68.34 8.32 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.178 1.919 . . . . 0.0 112.414 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -93.24 24.32 3.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.846 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.6 m -81.07 -18.04 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.014 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.1 117.91 22.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.968 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.85 -178.45 3.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.35 131.77 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 54.92 71.0 1.4 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.067 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.69 83.35 1.57 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.493 2.128 . . . . 0.0 112.352 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.23 108.89 2.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.811 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.6 m -92.95 133.28 34.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -92.3 30.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.646 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.0 p -90.14 148.16 4.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.194 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -71.55 -165.69 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -74.42 -20.51 79.58 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.54 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -89.97 113.1 24.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 110.947 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.551 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -82.17 -50.27 0.83 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 37.9 Cg_endo -66.46 147.93 83.2 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.03 1.82 . . . . 0.0 112.491 -179.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.855 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -76.65 138.39 40.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.591 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.872 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -166.88 179.14 5.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.709 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.582 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -48.39 -40.23 25.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.524 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.902 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 70.7 m -58.55 -47.96 82.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.975 0.417 . . . . 0.0 110.538 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.902 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.14 -42.93 86.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.179 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -59.64 -45.33 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.809 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.92 -12.16 34.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.338 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 m -76.46 -11.41 59.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.313 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.898 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . . . -139.14 61.01 18.96 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.406 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 63' ' ' PRO . 71.2 Cg_endo -100.47 124.03 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.217 2.612 . . . . 0.0 112.813 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 71.2 Cg_endo -98.03 30.76 12.73 Favored 'Cis proline' 0 N--CA 1.456 -0.698 0 C-N-CA 124.365 -1.098 . . . . 0.0 112.218 -0.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.852 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 46.9 mm-40 -52.78 -85.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.574 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 1.015 ' HG3' ' HG2' ' A' ' 69' ' ' MET . 6.7 pt-20 -106.63 28.37 7.94 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.171 0.51 . . . . 0.0 110.583 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -68.09 -18.51 64.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.348 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.656 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.89 28.79 4.49 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.714 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -131.92 -58.76 0.96 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.077 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 1.015 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -80.7 24.13 0.49 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -87.84 -42.61 12.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.39 0.614 . . . . 0.0 109.717 178.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.054 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -118.77 11.93 11.98 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.057 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -125.67 3.1 7.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.735 -0.232 . . . . 0.0 111.517 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.741 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.16 -33.02 2.68 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.957 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.855 HD22 HD12 ' A' ' 53' ' ' LEU . 2.6 mm? -56.84 -32.8 66.13 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.88 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 4.8 t80 -34.13 -62.58 0.37 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -173.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.88 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.9 Cg_exo -64.25 -17.96 61.58 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.906 1.737 . . . . 0.0 112.281 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.709 HD12 ' HB2' ' A' ' 53' ' ' LEU . 96.1 mt -98.53 -18.62 18.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.901 -0.591 . . . . 0.0 112.276 -177.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 8.7 mm -72.73 -46.44 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.937 0.399 . . . . 0.0 110.492 179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.678 ' HG2' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -52.65 -17.34 1.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.178 178.5 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.61 -37.41 36.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.712 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.31 -49.27 23.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.813 -179.321 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.695 ' ND1' HG11 ' A' ' 119' ' ' VAL . 1.9 m-70 -107.72 159.39 30.54 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.418 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.651 ' HD2' HD12 ' A' ' 85' ' ' LEU . 19.9 Cg_exo -65.39 72.17 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.524 2.15 . . . . 0.0 111.904 179.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.678 HG23 ' HG2' ' A' ' 79' ' ' GLN . 1.6 m 49.03 39.44 14.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.933 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.651 HD12 ' HD2' ' A' ' 83' ' ' PRO . 14.9 mt -95.83 9.15 41.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.276 -179.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.604 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -69.11 -140.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.718 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.511 ' H ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.27 -12.66 30.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.581 -0.819 . . . . 0.0 111.897 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.757 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -156.63 -23.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.786 HG21 HG13 ' A' ' 115' ' ' VAL . 56.9 mt -50.33 -84.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.227 -0.115 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.054 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -55.34 -36.84 66.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.674 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.03 -29.23 59.16 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.595 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 2.4 ttp -76.45 -35.65 58.36 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.019 -0.591 . . . . 0.0 109.672 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.732 ' HB3' ' HE1' ' A' ' 104' ' ' MET . 4.6 mm? -58.62 -6.93 0.81 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.72 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.684 ' HA ' HD12 ' A' ' 101' ' ' LEU . 1.3 mm? -108.14 27.17 9.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.4 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -170.78 3.21 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.334 -178.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.896 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.36 -151.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.346 0.593 . . . . 0.0 111.691 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.9 t70 -59.57 -2.59 0.36 Allowed 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.092 177.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 71.1 m-20 78.16 -27.84 0.16 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.377 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -31.5 60.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.001 0.429 . . . . 0.0 110.008 178.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.896 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.1 mt-10 -75.32 -23.71 57.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.786 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.805 HD23 HD12 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -75.04 -23.63 58.15 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.862 177.06 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.805 HD12 HD23 ' A' ' 101' ' ' LEU . 2.4 mp -92.47 -42.45 9.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.266 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.53 -39.55 85.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.273 -178.67 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.846 ' HB2' HD22 ' A' ' 111' ' ' LEU . 6.3 ptm -57.68 -33.61 68.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.63 HD21 HD13 ' A' ' 70' ' ' LEU . 12.6 mt -87.15 -10.54 52.46 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.917 -179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.93 -8.1 14.52 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -177.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.694 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.5 OUTLIER -139.9 132.64 15.04 Favored Pre-proline 0 C--N 1.33 -0.263 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.883 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 61.1 Cg_endo -72.03 4.56 3.15 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.663 2.242 . . . . 0.0 112.03 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 113' ' ' SER . 65.4 mt-10 -127.3 -13.09 5.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.494 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.694 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -77.51 -46.91 20.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.872 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.93 -40.7 14.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -66.1 0.93 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 3.9 m -47.06 -47.7 22.58 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.737 0.304 . . . . 0.0 111.429 -178.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 9.4 mmtt -64.69 -33.47 76.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.786 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -69.16 -55.05 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.411 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.3 t70 -54.04 -38.16 64.91 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.95 0.405 . . . . 0.0 110.456 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -75.2 -31.19 60.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.128 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.77 -21.21 62.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.946 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.695 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -67.77 -48.78 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.581 0 N-CA-C 109.479 -0.564 . . . . 0.0 109.479 176.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.6 -22.65 56.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.101 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 43.1 t -86.46 -33.99 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.46 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.757 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -70.97 -38.68 72.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.606 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -69.67 -28.85 66.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.907 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.696 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -88.7 -6.36 57.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.97 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 2.5 t-80 -115.59 -5.53 12.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.288 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 122' ' ' LEU . 6.6 mm100 -69.04 -104.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.953 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.33 31.16 2.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.693 0.283 . . . . 0.0 111.105 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.696 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 1.5 mttm -93.5 -157.02 0.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.261 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.66 24.08 1.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.727 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.483 ' CB ' ' HA ' ' A' ' 125' ' ' HIS . . . -86.73 36.8 0.72 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.307 -179.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.68 -10.76 49.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -88.78 164.64 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.859 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -22.59 21.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.999 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -81.99 134.49 35.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.101 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 3.7 m -104.33 133.88 47.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.079 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -92.55 159.87 15.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.95 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 3.4 t -99.4 -73.72 0.62 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.951 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -79.23 154.73 28.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.5 t -97.94 -35.68 10.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -91.03 56.99 3.28 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.479 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.607 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 3.9 t -96.06 -51.97 0.23 Allowed Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.431 0.16 . . . . 0.0 111.431 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.607 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 22.9 Cg_exo -65.27 -177.0 0.56 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.32 2.013 . . . . 0.0 112.183 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 p -83.69 68.94 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.074 -179.922 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 112.401 -0.28 . . . . 0.0 112.401 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -61.29 162.26 20.76 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.585 2.19 . . . . 0.0 112.201 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.88 146.47 26.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -97.3 136.87 12.99 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.393 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 147.4 24.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.773 0.32 . . . . 0.0 110.911 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.42 60.14 3.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.04 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.23 11.33 21.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -156.69 40.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.933 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 61.16 179.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.182 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.411 ' HA ' ' C ' ' A' ' 11' ' ' PRO . 23.6 p -135.13 135.39 22.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.828 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.411 ' C ' ' HA ' ' A' ' 10' ' ' THR . 12.7 Cg_exo -70.73 141.9 70.22 Favored 'Cis proline' 0 C--N 1.349 0.563 0 C-N-CA 123.847 -1.314 . . . . 0.0 112.416 0.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.22 -21.11 46.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.24 133.59 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.951 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 14' ' ' ARG . 21.8 mtp180 -86.56 -60.01 2.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.966 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.48 126.49 45.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.074 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.0 t -115.93 115.61 40.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.78 113.12 1.28 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.55 2.167 . . . . 0.0 112.277 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.22 -164.08 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.851 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -60.69 123.66 18.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.79 179.74 6.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.77 55.84 3.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.63 85.45 6.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.032 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.67 10.51 15.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.108 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.71 -66.46 1.67 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.363 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.3 p -105.8 126.51 61.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.919 0.39 . . . . 0.0 110.901 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 100.11 11.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.873 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.71 106.61 41.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.21 -70.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.549 2.166 . . . . 0.0 112.269 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -88.52 64.3 7.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -76.73 -72.48 0.34 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -156.93 -5.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.87 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 tp -72.49 113.79 9.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.73 -22.61 15.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.26 110.78 18.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.45 122.85 70.46 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.941 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.37 -154.3 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.449 2.099 . . . . 0.0 112.143 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -79.87 116.49 20.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.4 m -79.26 -13.79 13.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.972 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.97 127.03 33.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.887 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.13 140.57 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.486 ' H ' ' HG2' ' A' ' 41' ' ' GLN . 4.1 pt20 -106.59 125.44 51.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.822 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.451 ' HB2' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -64.4 -51.83 57.75 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.464 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.451 ' HD3' ' HB2' ' A' ' 42' ' ' GLN . 19.9 Cg_exo -66.28 -169.6 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.19 1.927 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.94 175.34 3.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.996 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 p -101.53 -29.89 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -101.03 -173.51 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.662 ' HB ' ' HB2' ' A' ' 50' ' ' GLN . 2.9 t -94.01 146.22 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.085 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.87 -26.62 23.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.963 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.491 ' H ' HG12 ' A' ' 47' ' ' VAL . . . -94.51 -18.2 36.48 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.623 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.662 ' HB2' ' HB ' ' A' ' 47' ' ' VAL . 11.9 mt-30 -102.31 52.75 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.871 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -70.66 127.89 91.49 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.839 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.58 -175.12 1.24 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.503 2.136 . . . . 0.0 112.31 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.754 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -91.01 148.38 22.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.015 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.844 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.56 -165.5 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.2 179.321 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -55.93 -38.21 69.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -60.09 -47.19 86.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.51 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.754 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.17 -43.78 87.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.178 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -57.24 -48.68 78.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.545 178.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.14 -3.58 20.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.447 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 36.2 t -88.26 -7.48 56.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.62 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -135.43 53.67 9.12 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.665 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.62 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 80.9 Cg_endo -103.69 114.09 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.148 2.566 . . . . 0.0 113.227 -178.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.524 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 91.6 Cg_endo -100.25 133.26 2.11 Favored 'Cis proline' 0 N--CA 1.456 -0.714 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.381 -0.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.501 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.6 OUTLIER -174.63 -85.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 179.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.722 ' HB3' ' HG2' ' A' ' 69' ' ' MET . 5.7 mm-40 -94.23 -0.93 54.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.959 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -52.99 -49.73 65.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.222 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.431 ' H ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -105.26 36.51 2.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.51 178.507 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.697 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 5.9 tp60 -136.06 -63.56 0.64 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.032 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.722 ' HG2' ' HB3' ' A' ' 65' ' ' GLU . 3.3 ptt? -81.44 22.53 0.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.942 HD23 ' H ' ' A' ' 70' ' ' LEU . 1.2 pt? -79.83 -43.47 22.32 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.889 -0.325 . . . . 0.0 111.18 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.008 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -140.49 31.84 2.2 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.331 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -140.66 -7.83 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.653 0.263 . . . . 0.0 111.241 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.27 -14.36 5.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.596 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -75.48 -15.61 60.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.212 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.676 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -47.29 -56.27 13.05 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.781 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.676 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 34.8 Cg_exo -60.35 -11.94 18.38 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.04 1.826 . . . . 0.0 112.272 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.588 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.7 mm? -98.47 -29.05 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.65 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.759 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.2 mm -65.47 -38.11 81.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 120.773 0.321 . . . . 0.0 111.185 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.941 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 20.2 mt-30 -52.02 -17.72 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.578 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.7 -37.25 22.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.276 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.759 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.24 -35.72 61.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.068 0.461 . . . . 0.0 110.682 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.791 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -126.08 155.84 72.86 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.696 -179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.558 ' HD2' HD12 ' A' ' 85' ' ' LEU . 25.1 Cg_exo -62.37 74.32 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.493 2.129 . . . . 0.0 111.854 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.941 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 6.2 p 48.37 31.4 2.72 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.987 -178.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.8 OUTLIER -83.67 4.97 26.26 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.17 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.66 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -67.89 -138.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.878 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 82.24 -16.4 23.41 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.667 -0.777 . . . . 0.0 111.683 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.889 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.7 ttpt -156.02 -20.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.84 HG21 HG13 ' A' ' 115' ' ' VAL . 60.0 mt -50.35 -81.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.008 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.27 -39.79 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.513 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.96 -28.11 60.43 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 176.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.889 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.6 ttm -76.71 -38.1 54.94 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.41 0.624 . . . . 0.0 109.617 176.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -57.85 -5.82 0.46 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.334 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.862 HD21 ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.6 27.37 9.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.569 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.461 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -170.14 1.29 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.211 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.945 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.18 -152.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.402 0.62 . . . . 0.0 111.654 -179.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 96' ' ' ILE . 1.8 t70 -59.58 -3.22 0.44 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.058 177.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.608 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.15 -34.91 0.16 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 123.733 0.645 . . . . 0.0 111.234 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -29.18 68.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.938 178.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.945 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -79.67 -26.23 41.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.802 177.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.561 HD12 HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -74.82 -27.17 60.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.618 176.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.88 -46.87 10.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.301 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.9 -39.94 87.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.118 -178.648 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.776 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -56.52 -34.13 66.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.521 -179.808 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' N ' ' HG3' ' A' ' 104' ' ' MET . 23.0 mt -85.67 -12.98 49.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.506 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -107.8 -2.05 20.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.37 -177.323 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.808 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -150.07 132.64 8.14 Favored Pre-proline 0 CA--C 1.53 0.207 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 54' ' ' THR . 16.6 Cg_exo -68.48 -1.66 7.8 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.933 2.422 . . . . 0.0 112.139 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -116.96 -29.38 6.01 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.057 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.808 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -62.11 -42.19 98.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.203 -178.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.844 ' HB3' HG22 ' A' ' 54' ' ' THR . 4.8 tt -59.77 -25.39 64.86 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.669 -0.413 . . . . 0.0 111.176 179.303 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.7 mtp180 -95.92 -66.09 0.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.923 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.53 ' HG ' ' HG3' ' A' ' 109' ' ' GLU . 1.5 m -42.82 -33.99 0.86 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.961 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 38.7 mmtt -81.77 -43.26 18.6 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.144 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.84 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.19 -58.4 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.49 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.46 -41.75 53.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.19 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -73.17 -31.07 64.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.066 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.799 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.29 -27.71 66.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.63 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.791 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.4 t -59.41 -53.15 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.611 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -54.27 -23.68 15.88 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.065 177.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 12.3 t -86.71 -30.96 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.65 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.793 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -74.51 -41.18 61.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.208 179.059 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.541 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -70.17 -28.71 65.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.401 0.62 . . . . 0.0 110.078 179.156 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.522 ' O ' ' HA ' ' A' ' 128' ' ' LYS . . . -76.78 -34.14 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.649 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.471 ' HA ' ' HG2' ' A' ' 128' ' ' LYS . 0.6 OUTLIER -88.43 -48.3 7.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.411 -178.459 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.653 ' HG3' HD12 ' A' ' 122' ' ' LEU . 7.8 mm-40 -56.92 -60.8 3.05 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.77 68.86 2.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.507 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -63.25 102.8 0.43 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.255 0.55 . . . . 0.0 111.977 -176.28 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.47 7.79 27.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.231 -0.895 . . . . 0.0 108.887 175.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -86.54 -5.34 59.17 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.428 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.0 97.5 0.37 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.935 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -98.7 -68.62 0.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.152 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -85.07 51.55 2.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.936 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -86.84 55.87 3.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.158 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.6 p -98.79 -18.7 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.933 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 45.8 p-10 -85.45 8.39 19.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.941 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.1 m -82.53 86.91 6.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.929 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.52 -42.13 83.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.018 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.7 p -98.88 132.23 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.45 -78.32 1.41 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.474 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.5 t -85.74 111.84 40.53 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.198 . . . . 0.0 111.091 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.63 -29.61 85.91 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.551 2.167 . . . . 0.0 112.373 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.9 p -85.6 45.24 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.932 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.43 ' OXT' HG13 ' A' ' 144' ' ' VAL . 3.5 p . . . . . 0 C--O 1.25 1.088 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.63 -59.51 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.638 2.225 . . . . 0.0 112.235 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -97.09 13.67 28.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.5 112.22 3.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.497 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.4 t -95.15 -52.8 4.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.877 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.84 128.65 13.36 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.997 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 56.21 42.71 27.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.144 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.52 27.76 0.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.044 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -101.32 95.7 6.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.178 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 65.2 p 46.62 72.0 1.4 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.363 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -62.98 113.82 2.17 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.602 2.201 . . . . 0.0 112.145 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -20.74 35.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.062 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.0 t -89.13 110.63 21.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.16 168.6 17.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.946 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -91.53 160.75 15.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 1.7 t -103.76 110.81 64.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -67.58 -12.69 36.51 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.437 2.091 . . . . 0.0 112.269 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -73.62 108.53 6.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.857 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -76.41 124.22 27.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.956 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.23 103.39 14.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.17 123.03 18.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.53 -48.54 69.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.014 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 156.07 33.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.037 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.05 17.2 57.48 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.475 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.2 m -105.57 145.43 13.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.96 -156.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.797 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -69.54 114.81 26.99 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.729 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -57.0 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.547 2.165 . . . . 0.0 112.383 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -89.56 113.74 25.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.967 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -94.74 139.63 30.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -7.7 59.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.041 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 tp -86.22 69.72 10.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.829 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.34 132.18 49.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.01 -4.32 52.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.169 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -87.79 152.33 51.23 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.84 154.33 13.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.533 2.155 . . . . 0.0 112.42 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.4 137.5 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.846 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.2 p -102.5 149.38 7.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.03 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.57 174.64 6.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.998 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.9 mmt -84.89 -169.82 2.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.831 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -116.78 56.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.832 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 55.94 82.75 0.24 Allowed Pre-proline 0 C--N 1.332 -0.174 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.965 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.17 179.77 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.519 2.146 . . . . 0.0 112.356 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.63 101.85 0.66 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.204 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 4.8 m -92.61 142.78 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.046 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -85.72 98.61 10.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.2 t -94.83 144.62 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -71.26 -53.28 14.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.093 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.25 176.07 40.04 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.557 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 93.54 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 110.901 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -82.35 132.07 53.93 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.981 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.39 -175.64 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.598 2.199 . . . . 0.0 112.354 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -82.68 149.35 27.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.874 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -167.52 -175.42 2.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.305 179.401 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.14 -34.14 21.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.278 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 20.0 m -64.01 -44.79 91.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.627 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.823 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -61.25 -42.04 97.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.207 178.858 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -61.88 -44.5 96.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.759 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.71 -12.41 58.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.292 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.2 m -76.92 -16.77 59.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.792 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -134.51 60.58 43.75 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.059 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.767 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.2 Cg_exo -53.1 -51.8 10.23 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.549 2.166 . . . . 0.0 113.102 -179.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 65.9 Cg_endo -95.85 21.53 0.45 Allowed 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.582 2.188 . . . . 0.0 112.536 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.792 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 20.4 mm100 -127.1 -94.03 0.46 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.654 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.594 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -105.44 27.72 8.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.665 -177.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.767 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -59.04 -43.03 91.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.861 0.362 . . . . 0.0 110.676 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HA ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -117.29 41.33 2.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.743 179.339 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -136.46 -54.66 0.74 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.281 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.594 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.3 ptt? -80.54 -1.84 43.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.784 -178.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.81 -43.12 99.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.591 0.234 . . . . 0.0 111.559 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.986 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.48 28.24 3.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.349 -0.929 . . . . 0.0 112.684 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -140.91 -2.97 1.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 0.0 111.194 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.59 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.35 -23.1 3.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.059 0.457 . . . . 0.0 110.721 -179.819 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.2 OUTLIER -74.04 -22.47 59.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.812 -178.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.679 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 6.6 t80 -44.95 -56.35 9.08 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.968 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.679 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.1 Cg_exo -61.12 -15.14 37.65 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.031 1.821 . . . . 0.0 112.371 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.725 HD12 ' HB2' ' A' ' 53' ' ' LEU . 82.9 mt -98.64 -25.51 14.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.909 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 74' ' ' LEU . 6.7 mm -65.23 -38.64 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-O 121.009 0.433 . . . . 0.0 110.667 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.709 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 3.0 mt-30 -53.64 -14.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.827 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -88.2 -30.46 19.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.189 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.493 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -84.0 -46.63 11.83 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -173.554 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.771 ' N ' ' HA ' ' A' ' 83' ' ' PRO . 0.1 OUTLIER -80.64 -35.57 0.86 Allowed Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 -171.309 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.771 ' HA ' ' N ' ' A' ' 82' ' ' HIS . 42.1 Cg_endo -96.41 -76.24 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.028 0 CA-C-N 120.65 1.268 . . . . 0.0 112.675 2.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.709 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 4.9 m -68.08 76.46 0.23 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.696 -178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 84' ' ' THR . 0.4 OUTLIER -145.68 10.33 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.43 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.601 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.79 42.43 0.3 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.448 -177.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -12.59 64.28 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.045 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.807 ' HE3' ' HB2' ' A' ' 92' ' ' MET . 7.8 ttpt 177.04 36.9 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.042 0.449 . . . . 0.0 110.091 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.903 HG21 HG13 ' A' ' 115' ' ' VAL . 67.4 mt -79.72 -90.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.169 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.986 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.3 -39.62 57.27 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.26 -32.17 57.1 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.02 -1.085 . . . . 0.0 110.838 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.807 ' HB2' ' HE3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -82.69 -25.57 32.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.367 178.637 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.617 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.3 mm? -59.6 -7.92 1.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.732 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 70' ' ' LEU . 1.8 mm? -106.19 27.33 8.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.5 pt-20 -166.43 1.53 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.463 -178.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.968 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.1 OUTLIER -62.83 -151.48 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.384 0.611 . . . . 0.0 111.73 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.541 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.2 t0 -59.08 -3.83 0.42 Allowed 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.085 178.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.566 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.1 m-80 79.55 -29.03 0.14 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.544 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -32.6 61.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.168 0.509 . . . . 0.0 109.827 178.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.968 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.8 mt-10 -74.08 -23.49 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.999 177.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.477 ' CB ' HD11 ' A' ' 96' ' ' ILE . 1.5 tp -74.86 -25.64 59.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.863 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.7 mp -88.27 -47.05 8.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.239 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.517 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.4 OUTLIER -63.12 -41.26 99.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.055 -178.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.862 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.6 OUTLIER -56.1 -34.0 65.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.348 -179.736 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.557 ' HA ' HD23 ' A' ' 58' ' ' LEU . 15.0 mt -87.15 -8.63 56.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.039 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 2.6 pt-20 -111.85 -7.98 14.15 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.68 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.42 131.7 14.08 Favored Pre-proline 0 C--N 1.331 -0.196 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.782 -179.134 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.575 ' O ' HG21 ' A' ' 54' ' ' THR . 16.7 Cg_exo -67.58 1.2 3.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.808 2.339 . . . . 0.0 112.103 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -127.19 -11.69 5.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.5 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.68 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -75.24 -46.16 35.6 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.292 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.874 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.48 -29.83 3.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.653 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -95.22 -64.06 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.076 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 27.8 t -46.24 -31.56 2.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.967 0.413 . . . . 0.0 109.981 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 15.8 mmtm -80.75 -41.05 24.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.88 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.903 HG13 HG21 ' A' ' 89' ' ' ILE . 1.5 t -64.38 -63.0 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.305 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.511 ' N ' HG12 ' A' ' 115' ' ' VAL . 9.6 t70 -48.84 -40.07 27.97 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 111.081 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.0 -35.61 66.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.796 0.332 . . . . 0.0 110.454 179.49 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.28 68.29 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.834 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.826 HG13 HD23 ' A' ' 122' ' ' LEU . 12.9 t -63.79 -47.76 89.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.141 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.58 37.09 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.455 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.8 t -87.13 -34.54 7.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.062 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.826 HD23 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -65.58 -33.56 76.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.335 178.209 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.434 ' O ' ' HB3' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -79.82 -24.76 41.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.703 177.685 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.603 ' O ' ' HB2' ' A' ' 130' ' ' ALA . . . -88.62 5.94 40.57 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.794 178.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -127.45 -27.62 2.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.994 0.426 . . . . 0.0 110.137 178.059 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.471 ' HB2' ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -87.91 -38.69 15.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.309 178.459 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 123' ' ' GLN . . . -95.36 -52.36 4.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.96 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.554 ' HG2' ' CA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.19 167.94 10.9 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.624 0.726 . . . . 0.0 111.094 179.69 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.1 86.08 6.81 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.571 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.603 ' HB2' ' O ' ' A' ' 124' ' ' ALA . . . -57.44 -62.37 1.83 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.138 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -86.15 149.81 24.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -98.61 51.85 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.908 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -68.39 -50.51 52.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -90.77 75.91 6.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.96 146.42 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.049 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -62.78 144.04 56.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.789 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.7 m -91.1 62.41 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.77 160.82 31.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.167 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.5 t -99.47 -21.66 15.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.874 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -84.44 173.84 50.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.466 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.43 125.03 89.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.698 0.285 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.6 142.18 25.8 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.513 2.142 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -16.72 38.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.053 179.959 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.167 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.85 -77.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.53 2.153 . . . . 0.0 112.348 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.7 -1.59 37.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.943 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.44 157.71 22.59 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.392 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.26 161.32 15.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 110.964 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.28 82.08 3.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.085 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -161.57 -54.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.61 -38.56 54.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.945 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -163.14 169.83 18.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.99 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.1 m 56.32 90.87 0.08 OUTLIER Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.093 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.552 ' HB2' HG23 ' A' ' 13' ' ' VAL . 28.7 Cg_endo -62.36 154.36 64.28 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.575 2.183 . . . . 0.0 112.205 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.99 34.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.552 HG23 ' HB2' ' A' ' 11' ' ' PRO . 4.8 t -100.29 147.28 7.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.018 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.6 mtt-85 -96.48 114.06 25.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.988 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.48 140.95 29.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 5.5 m -90.89 139.99 26.12 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 31.5 Cg_exo -59.66 -57.98 0.71 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.599 2.199 . . . . 0.0 112.173 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -89.03 151.83 22.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -75.06 -17.22 60.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.94 121.0 21.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -69.01 126.48 29.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.987 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.67 -162.65 0.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.002 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.63 99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.002 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.59 7.22 77.57 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.528 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 t -91.57 -41.83 13.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.5 mtt180 -71.08 102.54 2.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.481 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 73.2 m-20 -76.03 -51.83 2.72 Favored Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.383 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.481 ' HD3' ' HB2' ' A' ' 27' ' ' ASN . 72.0 Cg_endo -76.92 101.58 1.52 Allowed 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.119 1.879 . . . . 0.0 112.349 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -74.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -99.39 -18.28 17.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.757 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 55.25 39.61 31.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.013 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.84 91.87 8.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -91.47 -177.5 4.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.5 -2.19 30.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -81.05 152.06 70.92 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.09 50.19 3.45 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.725 2.284 . . . . 0.0 112.526 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -86.57 50.28 1.97 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.985 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -79.23 123.29 35.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.6 t -99.15 -12.44 20.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.939 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 9.6 ttt -100.98 92.12 4.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.083 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -148.47 137.55 21.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.706 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.685 ' N ' ' HA ' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -59.86 -50.64 85.64 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.533 -179.732 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.685 ' HA ' ' N ' ' A' ' 42' ' ' GLN . 67.7 Cg_endo -90.67 179.47 13.87 Favored 'Cis proline' 0 C--N 1.356 0.93 0 C-N-CA 124.599 -1.001 . . . . 0.0 112.503 0.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.96 132.74 53.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.093 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 m -80.83 133.76 28.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -98.48 -6.55 30.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.965 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 30.9 m -86.2 166.89 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.063 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -97.58 68.82 2.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.995 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -83.2 -71.36 1.32 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.472 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.96 157.57 18.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.737 0.303 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.66 ' N ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -77.98 -52.01 1.63 Allowed Pre-proline 0 CA--C 1.535 0.385 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.294 179.684 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.66 ' HA ' ' N ' ' A' ' 51' ' ' GLU . 95.4 Cg_endo -92.37 -41.34 0.28 Allowed 'Cis proline' 0 C--N 1.355 0.89 0 C-N-CA 124.657 -0.976 . . . . 0.0 112.884 0.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.95 HD22 ' HG ' ' A' ' 74' ' ' LEU . 0.1 OUTLIER -74.53 141.28 44.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 111.186 -179.671 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.884 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.95 -168.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.331 179.308 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -54.79 -38.91 67.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.507 -179.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.463 ' HB2' ' HE2' ' A' ' 57' ' ' MET . 1.2 m -60.42 -45.92 91.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 0.0 110.419 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.849 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.49 -43.14 88.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.065 178.688 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.15 -48.16 81.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.476 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.01 -2.6 15.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.355 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.469 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 27.7 t -88.99 -6.98 56.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.315 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.65 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.6 50.82 5.77 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.65 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 80.7 Cg_endo -103.06 121.71 0.07 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 123.016 2.477 . . . . 0.0 112.892 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.48 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 90.4 Cg_endo -100.26 124.96 1.48 Allowed 'Cis proline' 0 N--CA 1.455 -0.784 0 C-N-CA 124.51 -1.038 . . . . 0.0 112.41 0.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -168.26 -87.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.729 0.3 . . . . 0.0 111.134 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.563 ' HA ' ' HB3' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -96.15 6.89 47.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.857 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.0 -37.87 61.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.665 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -120.58 30.34 6.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.804 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.563 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 8.8 tt0 -131.69 -53.6 1.0 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.437 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.567 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -77.26 2.4 15.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.674 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.747 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -68.4 -39.49 81.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.611 -179.759 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.069 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.4 27.76 2.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.591 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -139.59 -10.16 1.22 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.618 0.247 . . . . 0.0 111.27 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.579 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.9 tmt_? -127.35 -14.82 5.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.307 . . . . 0.0 110.774 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.95 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.77 -14.63 59.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.484 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.643 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 5.6 t80 -49.39 -55.03 24.35 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.531 -178.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 37.4 Cg_exo -61.69 -9.35 13.51 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.083 1.855 . . . . 0.0 112.455 -179.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.69 -35.41 10.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.699 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.697 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.7 mm -60.09 -40.72 84.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.855 0.359 . . . . 0.0 110.601 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.779 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.2 mt-30 -49.19 -19.16 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.879 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.63 -41.63 17.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.908 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.449 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.31 -38.72 75.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.331 0.586 . . . . 0.0 110.412 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.717 ' CE1' HG21 ' A' ' 119' ' ' VAL . 5.3 m170 -121.71 148.69 51.37 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.442 -177.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.809 ' HD2' HD12 ' A' ' 85' ' ' LEU . 37.8 Cg_exo -60.33 74.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.441 2.094 . . . . 0.0 111.699 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.779 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.7 OUTLIER 48.83 28.33 1.88 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.643 -178.048 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.809 HD12 ' HD2' ' A' ' 83' ' ' PRO . 3.1 mt -80.69 2.41 26.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.146 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -68.05 -131.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.585 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 79.58 -18.55 6.97 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.045 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.864 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 1.3 ttpt -156.34 -20.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 70.1 mt -49.81 -79.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.069 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -54.78 -40.14 69.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.457 0.17 . . . . 0.0 110.824 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.33 -28.39 61.79 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.097 -1.049 . . . . 0.0 110.57 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.864 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 3.0 ttm -76.12 -36.69 58.72 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.581 0.705 . . . . 0.0 109.79 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.691 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -56.27 -9.47 0.67 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.619 -178.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.747 HD21 HD13 ' A' ' 70' ' ' LEU . 2.4 mm? -106.32 28.34 7.84 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 176.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 8.7 pt-20 -170.26 0.35 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.662 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.956 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.88 -148.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.464 0.65 . . . . 0.0 111.493 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 5.4 t70 -53.92 -10.14 0.3 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.99 176.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.698 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.5 m-80 79.87 -22.95 0.25 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.099 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -32.35 59.38 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.956 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -70.48 -29.89 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.864 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.695 HD23 HD22 ' A' ' 94' ' ' LEU . 2.2 tm? -69.36 -27.31 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.197 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.4 mp -87.96 -46.58 9.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.348 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.485 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -66.12 -39.83 90.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.567 -177.821 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.784 ' HB2' ' HA ' ' A' ' 111' ' ' LEU . 7.3 ptm -57.19 -35.87 70.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.715 0.293 . . . . 0.0 111.122 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.55 ' HA ' HD23 ' A' ' 58' ' ' LEU . 12.5 mt -85.7 -10.09 56.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.9 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.485 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -109.55 -8.51 14.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.175 -177.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.708 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -140.31 131.49 14.12 Favored Pre-proline 0 C--N 1.33 -0.276 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.865 -178.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.534 ' O ' HG21 ' A' ' 54' ' ' THR . 14.9 Cg_exo -69.14 2.4 3.21 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.978 2.452 . . . . 0.0 112.029 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -127.3 -11.99 5.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.671 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.708 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -77.16 -45.57 26.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.884 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.64 -41.21 14.37 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.779 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.6 -63.27 1.45 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.296 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -48.71 -55.11 12.31 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.348 . . . . 0.0 111.076 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 17.9 mmtt -57.6 -31.28 66.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -70.36 -58.63 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 115' ' ' VAL . 23.3 t70 -49.62 -38.92 33.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.285 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -43.99 68.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.187 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.724 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -58.4 -29.05 65.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.936 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.717 HG21 ' CE1' ' A' ' 82' ' ' HIS . 21.6 t -56.91 -51.5 67.4 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.789 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.02 -26.91 28.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.92 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.416 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 9.2 t -86.18 -31.03 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.875 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.76 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.92 -40.71 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.908 179.259 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 16.9 mm100 -61.97 -37.91 86.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.653 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.539 ' HB1' ' HE2' ' A' ' 128' ' ' LYS . . . -67.49 -79.87 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.235 176.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.462 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.6 OUTLIER -32.62 -36.13 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.705 0.628 . . . . 0.0 112.328 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 124' ' ' ALA . 12.4 mm100 -66.94 -78.33 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.303 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.46 26.55 4.31 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.776 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 1.2 ptpt -96.54 -161.62 0.89 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 111.122 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -87.93 26.59 1.32 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.674 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.776 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.28 -71.21 0.12 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.328 -177.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -81.14 -173.67 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -92.37 -69.95 0.72 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.993 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.83 -164.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.947 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.99 176.31 1.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.168 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.6 m -97.31 80.98 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.121 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -92.55 10.04 32.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.962 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.4 t -96.34 82.43 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -83.64 -72.01 0.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.14 -17.16 11.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -102.12 111.82 4.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.351 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 1.6 m -101.94 101.44 18.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.728 0.299 . . . . 0.0 111.187 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.81 -172.1 1.14 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.563 2.175 . . . . 0.0 112.316 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.9 p -83.87 -179.72 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.818 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.083 -179.909 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.436 -0.266 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.33 40.35 0.96 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.714 2.276 . . . . 0.0 112.435 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.05 141.99 41.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.58 164.92 28.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.505 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.5 p -101.26 -20.27 15.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.799 0.333 . . . . 0.0 110.984 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -128.33 1.93 5.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -92.33 -165.94 1.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.037 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.78 134.55 57.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -123.1 -18.56 6.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 48.6 p -92.96 141.38 24.08 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.009 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.43 108.95 2.63 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.512 2.141 . . . . 0.0 112.411 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.42 -30.71 21.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -104.18 143.15 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.071 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.8 mtt85 -71.67 119.13 15.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.977 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 p -111.27 117.35 32.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.602 ' HB ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 t -88.29 -51.34 0.4 Allowed Pre-proline 0 CA--C 1.532 0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.496 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.602 ' HD3' ' HB ' ' A' ' 16' ' ' VAL . 31.5 Cg_exo -59.34 121.91 10.68 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.198 1.932 . . . . 0.0 112.239 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -72.91 -178.71 2.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -75.02 81.93 2.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.923 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.52 161.35 13.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.54 -175.7 5.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -89.79 -62.22 1.52 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.065 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.49 165.53 11.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.174 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.98 42.87 3.19 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -98.93 132.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.328 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -93.27 112.01 23.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -83.88 110.25 24.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.65 81.1 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.47 2.113 . . . . 0.0 112.288 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -95.58 69.88 3.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.07 162.99 28.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -107.3 66.35 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.87 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.23 -37.11 11.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.965 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -77.38 -27.83 52.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.94 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.99 92.25 8.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -98.17 137.05 20.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.4 -153.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.52 2.146 . . . . 0.0 112.228 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.37 60.25 3.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -103.48 38.31 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.962 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 m -82.46 -21.44 35.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.961 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.1 tpp -88.11 3.18 50.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.0 tp60 -165.45 100.98 0.71 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.009 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -147.55 137.95 12.66 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.08 122.57 11.66 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.645 2.23 . . . . 0.0 112.313 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.75 118.04 28.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.0 t -83.52 103.99 11.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -108.03 58.14 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.822 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.799 HG22 ' H ' ' A' ' 49' ' ' GLY . 11.0 p -89.11 146.33 6.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.021 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -90.16 -0.14 57.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.088 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.799 ' H ' HG22 ' A' ' 47' ' ' VAL . . . -89.24 17.83 49.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.493 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -97.18 172.93 7.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.86 0.362 . . . . 0.0 110.911 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.485 ' HG2' ' H ' ' A' ' 51' ' ' GLU . 4.1 pt-20 -75.56 120.01 79.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.08 173.4 0.94 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.58 2.187 . . . . 0.0 112.309 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.824 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -80.77 143.78 32.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -164.64 -167.92 1.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.329 179.388 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.516 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -56.84 -37.44 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.093 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.1 m -61.12 -43.61 98.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.389 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.824 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -62.26 -41.49 98.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.149 178.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -59.25 -46.13 89.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.546 179.151 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.99 -12.17 61.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.3 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 28.5 t -76.37 -8.63 57.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.832 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.549 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -133.46 128.68 20.28 Favored Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.329 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.555 ' O ' ' N ' ' A' ' 64' ' ' GLN . 45.5 Cg_exo -55.0 -164.49 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 122.728 2.285 . . . . 0.0 110.698 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.434 ' HD2' ' CB ' ' A' ' 62' ' ' PRO . 82.7 Cg_exo -42.75 -14.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.935 1.757 . . . . 0.0 112.53 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.555 ' N ' ' O ' ' A' ' 62' ' ' PRO . 11.4 mt-30 -39.4 -88.42 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.414 177.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.762 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -105.38 8.51 33.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.935 -179.459 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -57.98 -24.48 58.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.05 0.452 . . . . 0.0 110.772 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.625 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -130.32 25.08 5.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 179.62 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.492 ' HB3' ' HA ' ' A' ' 65' ' ' GLU . 40.7 tt0 -130.25 -58.02 1.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.92 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.762 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -74.0 18.02 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -89.41 -39.46 13.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.119 0.485 . . . . 0.0 110.491 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.05 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -130.74 16.41 5.34 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.198 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -133.84 -11.09 2.67 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.477 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.585 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.77 -14.05 5.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.843 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.76 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -76.82 -12.06 59.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.131 179.392 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.735 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.1 t80 -46.81 -54.29 20.66 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.024 -178.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.735 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 28.1 Cg_exo -62.67 -15.62 47.54 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.205 1.937 . . . . 0.0 112.286 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.637 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.2 mm? -93.25 -28.13 16.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.486 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.771 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.0 mm -70.61 -40.18 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.781 0.324 . . . . 0.0 111.187 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.807 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 17.8 mt-30 -53.29 -16.43 1.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.346 0.593 . . . . 0.0 110.22 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.83 -37.23 22.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.062 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.771 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -75.17 -35.96 61.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.046 0.45 . . . . 0.0 110.704 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.9 m-70 -125.24 161.98 46.7 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.861 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.81 ' HG2' HD13 ' A' ' 85' ' ' LEU . 45.7 Cg_endo -67.59 72.16 0.66 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.402 2.068 . . . . 0.0 112.041 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.807 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 66.1 p 46.83 41.89 11.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.356 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.81 HD13 ' HG2' ' A' ' 83' ' ' PRO . 2.3 mp -99.15 11.06 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.69 22.33 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.986 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.04 -17.15 35.74 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.657 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' A' ' 92' ' ' MET . 4.3 ttpt -168.95 29.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.816 0.341 . . . . 0.0 111.06 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.884 HG21 HG13 ' A' ' 115' ' ' VAL . 67.5 mt -80.7 -90.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.07 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.05 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -52.04 -41.73 62.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.07 -32.31 49.64 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.113 -1.042 . . . . 0.0 111.146 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.685 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -85.69 -22.39 27.87 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 120.908 0.385 . . . . 0.0 110.45 179.437 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.586 ' HA ' HG23 ' A' ' 96' ' ' ILE . 3.9 mm? -60.22 -10.01 4.04 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.195 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.638 HD23 ' HA3' ' A' ' 71' ' ' GLY . 2.2 mm? -102.91 26.43 8.13 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.3 pt-20 -165.5 -0.62 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.916 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.94 -151.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.397 0.618 . . . . 0.0 111.633 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.615 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.7 t0 -53.83 -10.05 0.28 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.151 176.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.751 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.8 OUTLIER 79.16 -23.03 0.26 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.191 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -76.53 -25.98 54.72 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -77.96 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.779 177.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.776 ' HG ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.5 -21.41 66.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.865 178.094 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.776 HD23 ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -88.68 -52.4 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.23 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.6 OUTLIER -63.36 -38.75 92.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.223 -178.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.78 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -56.85 -35.1 68.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.567 HD21 HD13 ' A' ' 70' ' ' LEU . 21.7 mt -86.89 -10.15 54.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.942 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -110.18 -4.64 15.65 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -177.029 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.815 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.9 OUTLIER -141.93 130.0 11.81 Favored Pre-proline 0 C--N 1.332 -0.192 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.597 -179.918 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.536 ' O ' HG21 ' A' ' 54' ' ' THR . 21.9 Cg_exo -66.47 6.25 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.402 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 107' ' ' SER . 0.4 OUTLIER -131.54 -24.25 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.538 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.815 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.13 -42.62 99.54 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.76 -28.55 2.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.357 175.706 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.9 mtp85 -95.89 -66.63 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.073 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 22.7 t -44.93 -30.36 0.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.306 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -80.79 -42.27 22.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.953 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.884 HG13 HG21 ' A' ' 89' ' ' ILE . 1.9 t -64.25 -60.18 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.279 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.436 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.5 OUTLIER -51.31 -39.61 57.25 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.078 179.442 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.512 ' HB2' ' O ' ' A' ' 113' ' ' SER . 2.1 mt-10 -73.21 -33.9 65.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.916 0.388 . . . . 0.0 110.151 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.685 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.08 -27.46 67.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.668 HG11 ' ND1' ' A' ' 82' ' ' HIS . 22.0 t -60.57 -47.46 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.05 -25.9 59.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.557 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 5.1 t -86.56 -31.26 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.799 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.6 -40.08 66.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.927 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -64.02 -38.59 91.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.94 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.737 ' HB1' ' HE2' ' A' ' 128' ' ' LYS . . . -70.96 -77.72 0.08 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.396 177.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.3 OUTLIER -33.19 -34.58 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.725 0.641 . . . . 0.0 112.279 -178.237 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 124' ' ' ALA . 2.3 mt-30 -65.03 -80.76 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.271 179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.48 25.82 4.81 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.737 ' HE2' ' HB1' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.18 -163.09 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.221 0.534 . . . . 0.0 111.054 179.128 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.92 29.41 0.93 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.706 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.696 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.73 -71.74 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.436 -177.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.06 169.84 16.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.242 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.29 45.26 1.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.963 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -60.66 -58.66 7.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.907 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -91.08 141.72 28.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.155 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 1.7 t -87.67 43.96 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.949 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -74.74 103.89 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.54 -169.77 2.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.881 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.47 132.86 51.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.094 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.53 -162.71 0.96 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.86 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -101.31 -14.65 29.92 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.575 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.602 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 4.0 t -84.78 -50.89 0.56 Allowed Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.602 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 32.2 Cg_exo -59.47 -12.57 17.52 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.241 1.961 . . . . 0.0 112.468 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -74.92 0.21 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.874 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.095 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.74 158.55 56.6 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.576 2.184 . . . . 0.0 112.242 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -97.34 102.28 14.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.918 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.56 -80.55 1.54 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.609 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.8 m -85.31 -169.77 2.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.742 0.306 . . . . 0.0 110.922 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.6 -92.8 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.099 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.93 76.28 0.26 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.98 -33.07 0.34 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.073 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.83 13.28 14.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.057 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.573 HG22 ' HD2' ' A' ' 11' ' ' PRO . 0.0 OUTLIER -119.94 145.52 39.9 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.962 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.573 ' HD2' HG22 ' A' ' 10' ' ' THR . 65.6 Cg_endo -73.26 175.76 10.12 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.537 2.158 . . . . 0.0 112.28 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.49 -17.94 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.946 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.95 82.62 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.028 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -78.5 -13.69 59.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.8 p -110.48 163.56 13.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.405 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 3.4 m -102.74 125.63 35.14 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.091 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 47.8 Cg_exo -56.65 -56.24 2.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.58 2.187 . . . . 0.0 112.343 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.29 148.53 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.038 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.86 172.08 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.985 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -77.19 167.0 22.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.873 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -84.8 104.39 14.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.931 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.89 -173.95 1.35 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.015 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.59 117.61 13.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.101 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.94 33.1 4.57 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.4 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.431 ' O ' HG22 ' A' ' 25' ' ' VAL . 7.3 p -105.81 36.25 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-O 121.312 0.577 . . . . 0.0 110.831 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.51 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -73.45 -169.68 0.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.076 179.898 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.63 ' H ' ' HD2' ' A' ' 28' ' ' PRO . 1.5 m-20 -94.22 -51.17 0.25 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.661 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.63 ' HD2' ' H ' ' A' ' 27' ' ' ASN . 32.8 Cg_endo -63.65 115.4 3.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.129 1.886 . . . . 0.0 112.347 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -78.87 155.4 29.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.789 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.49 108.26 20.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.04 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 14.19 17.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.837 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.01 -62.87 1.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -82.3 -75.75 0.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.86 120.11 15.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.071 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.497 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -86.34 -51.3 0.47 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.519 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 57.7 Cg_endo -71.01 129.27 16.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.149 1.899 . . . . 0.0 112.335 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -101.6 24.3 9.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.841 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.1 p -97.28 -9.7 8.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.099 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.54 -64.29 1.22 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.113 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.54 64.5 8.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.101 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -160.34 38.18 0.17 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.905 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -157.49 105.02 1.83 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.003 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.91 149.49 59.67 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.481 2.121 . . . . 0.0 112.274 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.48 109.39 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.111 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.77 175.92 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.02 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -98.53 155.76 17.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.886 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 27.1 m -85.93 155.38 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.031 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.14 -34.3 63.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.06 105.82 2.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.356 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.06 49.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.879 0.371 . . . . 0.0 111.173 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.629 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 20.7 mt-10 -74.47 -50.74 4.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.301 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.629 ' HD3' ' HB2' ' A' ' 51' ' ' GLU . 31.8 Cg_exo -59.54 121.35 9.73 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.297 1.998 . . . . 0.0 112.319 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.513 HD12 ' CD1' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -69.46 134.64 49.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.033 179.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.916 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -169.8 -177.81 2.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.175 178.312 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.953 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.32 -35.79 51.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.806 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 5.7 m -66.58 -47.91 71.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.364 . . . . 0.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.806 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.17 -41.98 85.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.258 0.551 . . . . 0.0 110.369 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.953 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.1 mt -63.17 -45.94 89.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.812 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.58 -10.34 44.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.488 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 57' ' ' MET . 23.2 t -83.15 -8.02 59.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.736 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.747 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.37 56.63 21.93 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.182 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.722 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 53.6 Cg_exo -52.73 -51.17 11.72 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.491 2.127 . . . . 0.0 113.337 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.588 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 67.8 Cg_endo -94.58 12.56 1.55 Allowed 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.434 2.089 . . . . 0.0 112.632 -179.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.747 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 5.5 tt0 -122.13 -95.07 0.49 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.628 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.691 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 0.0 OUTLIER -106.99 37.09 2.45 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.179 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.722 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -59.62 -50.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.96 0.41 . . . . 0.0 110.497 179.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -116.51 36.03 4.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.577 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -126.76 -50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.421 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.656 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.2 OUTLIER -80.62 -3.38 50.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.642 -178.668 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.771 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -61.09 -38.57 86.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.39 -179.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.982 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -136.94 28.91 2.78 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.581 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -142.95 0.18 1.19 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 111.044 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.428 ' CB ' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -130.37 -22.62 2.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.692 179.157 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -75.98 -24.88 55.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.826 178.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.467 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -41.14 -55.96 4.58 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.044 -177.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.0 Cg_endo -71.48 -15.37 30.94 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.028 1.819 . . . . 0.0 112.232 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 53' ' ' LEU . 81.3 mt -92.16 -20.64 21.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.524 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.71 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 8.6 mm -73.08 -36.17 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HG2' HG22 ' A' ' 84' ' ' THR . 3.7 mt-30 -52.8 -13.06 0.37 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.097 177.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -84.09 -44.42 14.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.9 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.71 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.45 -35.78 73.53 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.526 0.679 . . . . 0.0 110.164 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.683 ' ND1' HD13 ' A' ' 89' ' ' ILE . 5.5 m170 -119.53 139.91 28.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.944 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.429 ' O ' HG23 ' A' ' 84' ' ' THR . 54.7 Cg_exo -30.98 -48.91 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.82 2.347 . . . . 0.0 112.215 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.627 HG22 ' HG2' ' A' ' 79' ' ' GLN . 0.0 OUTLIER 176.59 14.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.89 177.509 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.86 3.87 0.97 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.424 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.729 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -78.32 47.37 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.247 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.78 -7.32 78.48 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.943 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 4.8 ttpt -174.4 28.35 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.783 0.325 . . . . 0.0 110.977 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.858 HG21 HG13 ' A' ' 115' ' ' VAL . 56.1 mt -80.1 -83.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.757 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.982 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.1 -40.88 59.43 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.476 0.179 . . . . 0.0 110.669 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.14 -31.76 56.46 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.943 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 4.6 ttm -73.8 -39.34 64.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.272 176.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -54.18 -10.76 0.39 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.843 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.771 HD21 HD13 ' A' ' 70' ' ' LEU . 1.7 mm? -105.15 28.68 7.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.4 pt-20 -171.52 -0.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.04 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.996 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.92 -150.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.488 0.661 . . . . 0.0 111.735 -179.325 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.6 ' N ' HG12 ' A' ' 96' ' ' ILE . 6.7 t70 -55.49 -9.35 0.47 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.204 176.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.733 ' H ' HG12 ' A' ' 96' ' ' ILE . 12.3 m120 79.45 -24.64 0.2 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.103 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -74.32 -29.35 61.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.996 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.57 -38.53 62.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.556 176.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.571 ' N ' HD11 ' A' ' 96' ' ' ILE . 0.3 OUTLIER -64.23 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.986 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.36 -48.62 7.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.203 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.453 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -65.1 -41.43 94.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.318 -178.299 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.839 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -56.32 -34.31 66.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.443 -179.354 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.668 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.2 mt -86.66 -11.22 51.95 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.797 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.16 -7.99 15.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.737 0.644 . . . . 0.0 112.737 -176.68 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.3 OUTLIER -141.95 135.73 14.63 Favored Pre-proline 0 C--N 1.332 -0.164 0 C-N-CA 120.598 -0.441 . . . . 0.0 112.008 -178.69 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.503 ' O ' HG21 ' A' ' 54' ' ' THR . 62.5 Cg_endo -72.18 0.52 7.19 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.697 2.265 . . . . 0.0 111.906 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -123.99 -10.89 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.323 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.81 -46.89 17.75 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.095 0.474 . . . . 0.0 109.737 178.059 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.916 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.5 -39.62 16.49 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.163 176.336 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.425 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.5 ttt-85 -80.18 -59.2 2.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.273 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.425 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 3.3 t -52.66 -56.82 12.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.981 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.595 ' HD3' ' HG3' ' A' ' 100' ' ' GLU . 0.8 OUTLIER -55.21 -32.24 62.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.858 HG13 HG21 ' A' ' 89' ' ' ILE . 1.8 t -69.58 -60.96 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.079 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.435 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.7 OUTLIER -50.24 -36.8 32.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 111.176 178.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -38.99 65.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.263 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.635 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -61.85 -30.02 70.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 177.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 115' ' ' VAL . 14.6 t -56.2 -53.74 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.933 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.44 -27.07 22.78 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.928 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.562 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 9.2 t -85.68 -31.71 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.954 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -70.82 -43.39 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.815 179.211 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.508 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 18.1 mm100 -68.88 -25.6 64.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.214 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.435 ' HA ' ' CD ' ' A' ' 128' ' ' LYS . . . -88.66 -12.67 41.77 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.354 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.787 ' HA ' ' HB3' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -114.07 -2.92 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.499 -179.057 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 122' ' ' LEU . 6.4 mm-40 -68.65 -103.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.079 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.25 18.01 13.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.77 0.319 . . . . 0.0 111.252 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.435 ' CD ' ' HA ' ' A' ' 124' ' ' ALA . 0.2 OUTLIER -79.97 -156.22 0.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.113 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -87.2 -14.65 40.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.613 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.787 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . . . -69.38 -13.8 62.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.097 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.84 101.75 0.22 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.086 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -80.53 137.85 36.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.957 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -80.52 154.36 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -93.34 77.39 4.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.015 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.62 -28.88 3.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -84.83 166.39 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.013 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.61 16.22 16.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -84.69 -2.54 57.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.023 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.68 143.62 26.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -79.18 112.5 3.46 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.574 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 10.5 m -78.64 140.72 59.54 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.088 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.7 103.4 1.56 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.496 2.13 . . . . 0.0 112.329 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.1 m -83.51 -74.34 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.014 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.014 -179.992 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.45 161.49 31.12 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.616 2.211 . . . . 0.0 112.15 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.99 25.06 6.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.38 -10.73 67.73 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.418 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -76.63 -178.44 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.45 23.01 2.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -161.61 -95.12 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 56.52 20.66 5.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.283 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -165.39 -37.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.103 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.5 89.37 0.11 Allowed Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.06 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.3 155.48 55.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.528 2.152 . . . . 0.0 112.287 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.52 -67.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.986 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.96 134.59 29.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.034 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 -33.73 22.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.037 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.1 m -82.75 146.88 28.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.048 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.65 127.25 33.06 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.465 ' HB2' ' H ' ' A' ' 18' ' ' GLN . 88.1 Cg_endo -77.8 -134.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.563 2.176 . . . . 0.0 112.161 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.465 ' H ' ' HB2' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -70.73 155.76 40.36 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 110.886 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -79.26 58.58 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.127 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.63 85.3 2.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.009 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -88.6 74.6 8.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.944 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -89.85 153.96 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.041 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.55 35.04 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.068 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.81 -4.83 89.57 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.492 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.7 t -108.38 -33.34 2.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.82 0.343 . . . . 0.0 110.958 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -77.13 140.0 40.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.91 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -71.8 147.96 92.02 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.68 100.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.517 2.145 . . . . 0.0 112.288 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -85.67 80.09 9.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -89.38 168.13 12.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -64.14 -30.13 71.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 mp -92.17 104.08 16.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.976 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -84.91 -55.98 3.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.811 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -94.59 177.17 6.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.064 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -104.89 102.36 34.95 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.02 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.36 113.99 3.79 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.397 2.065 . . . . 0.0 112.262 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.415 ' OE1' HG11 ' A' ' 47' ' ' VAL . 43.8 mt-30 -85.01 122.72 29.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.975 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.99 137.43 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.952 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -105.6 108.73 20.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.998 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.12 127.42 46.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -105.01 103.32 12.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.012 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.421 ' HA ' ' HA ' ' A' ' 43' ' ' PRO . 5.5 mt-30 58.33 95.23 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.203 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 42' ' ' GLN . 87.8 Cg_endo -81.72 138.42 39.39 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.528 -1.447 . . . . 0.0 112.541 -0.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -90.12 104.38 16.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.033 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.28 141.58 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.181 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -87.48 158.6 18.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.497 ' HB ' ' H ' ' A' ' 48' ' ' GLN . 1.7 m -110.83 -157.09 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.962 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.497 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 22.3 mt-30 -68.07 -176.89 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.927 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.84 37.66 3.07 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.509 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.68 37.53 1.69 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.722 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' N ' ' CD ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -77.6 -48.69 2.26 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.574 -179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' CD ' ' N ' ' A' ' 51' ' ' GLU . 52.0 Cg_exo -55.87 178.0 0.12 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.317 2.012 . . . . 0.0 112.452 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.869 ' H ' HD23 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -79.76 141.21 36.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.164 -179.554 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.68 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.33 -169.06 1.01 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.682 178.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 1.017 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -53.52 -40.26 65.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.665 0.269 . . . . 0.0 111.431 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.5 m -59.27 -51.54 69.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.715 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.581 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.56 -39.11 79.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.296 179.069 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 55' ' ' ALA . 17.8 mt -62.9 -42.89 99.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.89 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.2 -16.72 62.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.148 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 57' ' ' MET . 72.9 m -74.19 -7.21 51.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.61 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.65 60.12 44.5 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.357 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.621 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 47.0 Cg_exo -56.63 -51.97 7.96 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.448 2.099 . . . . 0.0 113.246 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 74.9 Cg_endo -89.87 -18.01 1.57 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 122.262 1.975 . . . . 0.0 112.537 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.61 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.9 OUTLIER -80.91 -80.57 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.731 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.59 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.3 OUTLIER -106.85 -91.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.621 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER 71.69 -63.53 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.397 -178.489 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.483 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -109.08 25.22 12.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 178.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 65' ' ' GLU . 2.2 mm100 -121.58 -50.76 2.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -81.17 5.97 15.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.92 -178.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.799 HD13 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -65.86 -57.27 8.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 179.816 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.007 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -113.05 33.62 5.49 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.732 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -144.41 -3.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.824 0.345 . . . . 0.0 111.297 -178.686 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.659 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -125.68 -26.26 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.527 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.841 HD22 HD22 ' A' ' 53' ' ' LEU . 1.6 mm? -63.5 -33.14 74.92 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.297 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.796 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 16.2 t80 -39.2 -60.23 1.27 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.796 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 32.5 Cg_exo -57.92 -19.45 39.8 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 121.851 1.701 . . . . 0.0 112.342 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.869 HD23 ' H ' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -98.83 -25.96 14.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.318 -178.109 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.679 HG12 ' O ' ' A' ' 74' ' ' LEU . 5.4 mm -65.85 -40.03 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.782 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 18.4 mt-30 -51.5 -19.36 1.4 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.521 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.26 -36.85 26.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.837 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.49 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -73.79 -34.56 64.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.769 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.6 m-70 -130.44 148.03 68.3 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.572 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 85' ' ' LEU . 51.2 Cg_exo -55.65 79.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.537 2.158 . . . . 0.0 112.364 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.782 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 20.0 p 42.89 37.68 1.17 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.529 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 10.8 mt -95.66 12.46 29.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.1 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.471 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -76.02 24.16 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.558 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -59.18 -19.14 44.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.681 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.644 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 0.9 OUTLIER -169.11 32.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.89 0.376 . . . . 0.0 111.012 179.681 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.805 HG21 HG13 ' A' ' 115' ' ' VAL . 64.0 mt -80.56 -92.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.888 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.007 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -50.82 -40.56 56.02 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.01 -31.33 55.78 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.209 -0.996 . . . . 0.0 110.973 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.709 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.79 -22.16 29.67 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 120.864 0.364 . . . . 0.0 110.098 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 mm? -62.48 -4.41 1.9 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.195 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 70' ' ' LEU . 3.1 mp -106.61 24.32 12.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.465 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 10.5 pt-20 -166.8 0.83 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.481 -178.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -152.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.554 0.693 . . . . 0.0 111.797 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.459 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.4 t0 -59.27 -3.28 0.38 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.157 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.617 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.1 OUTLIER 79.62 -34.07 0.14 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.244 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 103' ' ' HIS . 1.4 m -69.18 -24.79 64.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.102 178.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.904 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.3 mt-10 -84.04 -27.05 28.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.427 177.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 0.1 OUTLIER -74.89 -27.48 60.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.246 175.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.434 HD23 HD23 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -83.92 -48.79 9.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.873 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.534 ' ND1' ' HB3' ' A' ' 110' ' ' SER . 0.2 OUTLIER -61.93 -47.74 83.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.422 -178.57 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.716 ' O ' ' HB2' ' A' ' 55' ' ' ALA . 5.7 ptm -52.15 -36.44 51.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.455 -178.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.81 HD23 HD13 ' A' ' 58' ' ' LEU . 54.4 mt -81.83 -14.71 55.94 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.857 -179.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.479 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -106.2 -10.61 16.38 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -176.934 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.534 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -143.2 136.27 13.86 Favored Pre-proline 0 N--CA 1.465 0.278 0 C-N-CA 120.283 -0.567 . . . . 0.0 112.241 -178.62 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.561 ' O ' HG21 ' A' ' 54' ' ' THR . 7.6 Cg_exo -73.69 3.88 4.52 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.017 2.478 . . . . 0.0 112.156 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -123.99 -22.07 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.561 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.534 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 2.4 p -64.05 -55.97 18.32 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.377 0.608 . . . . 0.0 109.857 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 54' ' ' THR . 7.5 tt -48.8 -31.09 6.48 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.572 -179.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 113' ' ' SER . 7.2 ttt85 -88.17 -60.56 1.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.308 -179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.4 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 49.6 m -56.5 -34.75 67.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.122 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -78.5 -31.22 47.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.78 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.805 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.77 -51.71 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -32.96 69.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.336 177.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -79.58 -31.07 41.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.574 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.709 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -68.32 -23.77 64.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.492 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.769 HG11 ' ND1' ' A' ' 82' ' ' HIS . 17.0 t -64.86 -57.24 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.609 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.428 ' HA ' ' CG ' ' A' ' 123' ' ' GLN . . . -53.27 -23.78 9.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.885 177.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 24.2 t -86.62 -32.54 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.433 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.68 -43.87 65.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.234 179.207 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.549 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -66.19 -31.5 72.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.829 178.327 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.434 ' HA ' ' CD ' ' A' ' 128' ' ' LYS . . . -81.76 -16.28 51.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.139 179.133 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -112.51 8.21 19.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.172 -179.566 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -77.3 -105.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.809 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.58 23.01 6.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.787 0.327 . . . . 0.0 111.325 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.434 ' CD ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -89.04 -146.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.138 -179.483 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.62 19.35 1.05 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.693 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -62.09 -54.47 40.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.087 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -82.43 118.27 23.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.018 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -89.47 -78.34 0.36 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.26 134.4 41.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.62 -69.84 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.046 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 15.2 m -103.05 139.46 23.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.021 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.39 59.58 4.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.44 145.92 29.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.891 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.82 -35.53 78.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.997 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 97.71 10.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.04 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -107.2 -144.46 11.58 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.641 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.417 ' HA ' ' HA ' ' A' ' 142' ' ' PRO . 6.2 p -72.43 134.38 82.34 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.444 0.164 . . . . 0.0 111.025 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' ' 141' ' ' VAL . 61.3 Cg_endo -90.28 -77.61 0.0 OUTLIER 'Cis proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.777 -1.343 . . . . 0.0 112.583 0.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.3 m -99.57 -67.59 0.84 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.824 0.345 . . . . 0.0 110.888 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 9.5 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.037 -179.841 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 121.96 8.82 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.578 2.185 . . . . 0.0 112.356 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.0 3.57 33.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.778 179.876 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.5 149.06 16.65 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.563 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.4 m -93.84 47.79 1.24 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.683 0.278 . . . . 0.0 110.947 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.71 115.38 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.19 69.28 0.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.056 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.72 142.75 36.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.125 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -104.79 18.31 22.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.121 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.0 p -120.14 86.31 37.35 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.29 142.08 48.96 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.594 2.196 . . . . 0.0 112.348 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.42 32.91 2.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 179.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 t -89.76 101.08 11.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.096 179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -77.26 -5.7 50.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.95 -162.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.907 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.89 118.93 42.0 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.13 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.34 -16.2 31.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.602 2.202 . . . . 0.0 112.288 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -92.93 122.51 35.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.895 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -78.2 174.96 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.21 131.94 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.97 179.716 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -86.12 96.99 10.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.3 95.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.072 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.72 113.09 9.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.058 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.21 -14.22 39.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.503 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.0 p -98.85 141.28 16.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.12 157.42 20.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.828 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.41 118.78 62.89 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.952 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.69 -64.52 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.56 2.173 . . . . 0.0 112.115 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -99.8 -167.99 1.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.75 -88.02 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.852 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 55.48 19.8 3.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 33' ' ' ASN . 0.1 OUTLIER -99.63 177.08 5.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.988 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.503 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -88.46 -171.68 3.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.805 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.41 120.06 23.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -51.11 1.19 Allowed Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.393 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.42 137.01 75.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.134 1.89 . . . . 0.0 112.215 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -92.31 139.82 30.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.811 179.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -90.7 117.47 34.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.275 -179.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -104.8 -44.87 4.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 179.521 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -146.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.703 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.412 ' HB3' ' H ' ' A' ' 42' ' ' GLN . 11.3 mm100 58.0 -146.88 0.52 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.743 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.412 ' H ' ' HB3' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -56.04 123.1 51.94 Favored Pre-proline 0 C--O 1.232 0.181 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.932 -179.911 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.53 121.86 10.69 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.62 2.214 . . . . 0.0 112.475 -179.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -84.16 122.66 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.917 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.524 HG21 ' HE ' ' A' ' 112' ' ' ARG . 3.8 m -82.72 2.66 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.354 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -87.95 130.98 34.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.82 179.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.777 HG12 ' H ' ' A' ' 49' ' ' GLY . 11.4 t -106.24 131.2 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.019 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -84.51 -5.93 59.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.929 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.777 ' H ' HG12 ' A' ' 47' ' ' VAL . . . -93.2 -93.4 1.51 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.469 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.54 142.41 35.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.813 0.34 . . . . 0.0 110.856 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 119.95 74.29 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.896 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.09 164.04 13.11 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.631 2.221 . . . . 0.0 112.264 -179.84 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.793 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.1 OUTLIER -76.74 147.06 37.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.841 179.75 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -169.44 -161.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.37 179.229 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.6 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -58.26 -35.38 71.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.394 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 72.9 m -60.39 -49.43 77.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.223 179.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.793 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.22 -42.34 86.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.306 178.659 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.616 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.93 -45.11 91.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.815 179.459 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.27 -16.07 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.337 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.5 t -75.95 -13.52 60.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.744 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.758 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -134.89 61.1 45.31 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.993 179.497 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.809 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 52.9 Cg_exo -54.95 -53.1 6.52 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.451 2.101 . . . . 0.0 113.245 -178.801 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.5 Cg_endo -97.69 11.14 1.03 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 122.58 2.187 . . . . 0.0 112.567 -179.28 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.758 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 20.6 mm-40 -113.97 -93.6 0.48 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.593 -178.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.803 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.11 36.89 2.52 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.044 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.809 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.02 -35.89 81.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 0.0 110.505 179.086 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -118.87 39.69 3.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.785 179.55 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -135.82 -59.27 0.76 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.371 -179.572 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.803 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 5.5 ptt? -79.89 12.48 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.859 -178.634 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.807 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -76.62 -40.56 48.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.748 0.309 . . . . 0.0 111.077 179.052 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.047 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -133.7 23.98 3.72 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.224 -0.989 . . . . 0.0 112.693 -179.276 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.61 -7.37 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.708 0.29 . . . . 0.0 111.225 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 2.8 tmt_? -127.13 -15.25 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.906 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.673 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -77.11 -8.86 58.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.228 179.524 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.711 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.1 t80 -50.02 -55.82 21.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.445 -178.516 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 19.9 Cg_exo -64.89 -9.64 22.11 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.057 1.838 . . . . 0.0 111.852 179.513 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.784 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 1.9 mm? -93.22 -34.21 13.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.365 -179.52 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.778 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 5.5 mm -66.74 -38.87 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.872 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.729 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.4 mt-30 -50.93 -18.25 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.444 0.64 . . . . 0.0 110.198 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -83.82 -43.11 15.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.225 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.71 -38.73 73.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.427 0.632 . . . . 0.0 110.424 -179.898 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.659 ' ND1' HD13 ' A' ' 89' ' ' ILE . 3.9 m170 -121.95 151.24 57.75 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.414 -177.132 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.826 ' HG2' HD23 ' A' ' 85' ' ' LEU . 30.5 Cg_endo -62.58 75.82 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.272 1.982 . . . . 0.0 111.778 179.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.729 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.4 OUTLIER 50.43 28.85 3.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.743 -178.786 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.826 HD23 ' HG2' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -80.22 0.62 31.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.375 -178.897 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.756 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -66.78 -144.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.47 -3.58 86.12 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.915 -179.441 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.73 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -167.82 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.778 -0.211 . . . . 0.0 111.111 -179.826 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.836 HG21 HG13 ' A' ' 115' ' ' VAL . 76.6 mt -49.68 -82.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.689 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.047 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -55.57 -38.12 68.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.597 0.237 . . . . 0.0 110.729 179.748 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.54 -29.05 57.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.686 177.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.591 ' O ' HG23 ' A' ' 96' ' ' ILE . 2.3 ttp -76.88 -33.62 57.82 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.098 -0.551 . . . . 0.0 109.876 177.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.553 ' O ' HD23 ' A' ' 101' ' ' LEU . 4.6 mm? -59.86 -5.2 0.88 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.642 -178.215 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.807 HD11 HD13 ' A' ' 70' ' ' LEU . 3.2 mp -109.08 25.78 11.4 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 176.483 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -169.91 3.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.289 -178.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.942 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.06 -151.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.242 0.544 . . . . 0.0 111.66 -179.752 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 6.3 t0 -59.53 -2.48 0.34 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.206 178.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-80 78.0 -28.74 0.16 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.443 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 m -75.32 -27.05 59.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.054 0.454 . . . . 0.0 109.888 178.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.942 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.0 OUTLIER -80.41 -22.19 41.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.938 177.916 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' A' ' 96' ' ' ILE . 2.1 tm? -75.2 -24.98 57.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.723 176.73 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.3 mp -90.25 -45.14 9.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.359 -179.21 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.09 -36.79 80.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.007 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.632 ' HE2' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.87 -36.03 73.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 179.785 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.616 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.7 mt -87.01 -10.47 53.05 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.186 0.517 . . . . 0.0 109.991 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -108.02 -3.46 18.72 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.157 -176.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.0 OUTLIER -150.75 131.46 7.22 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.204 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.485 ' O ' HG21 ' A' ' 54' ' ' THR . 16.9 Cg_exo -68.03 -2.02 8.04 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.931 2.42 . . . . 0.0 112.064 179.509 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.463 ' HG3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -117.31 -28.52 6.12 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.343 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.821 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -62.63 -42.93 99.87 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.469 -178.887 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.864 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.9 tt -61.25 -30.6 70.55 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.281 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.528 ' HG2' ' N ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -89.48 -63.52 1.27 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 0.0 110.5 180.0 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.528 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 2.7 m -49.41 -36.85 23.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.386 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.473 ' HD2' ' OE2' ' A' ' 100' ' ' GLU . 33.3 mmtt -80.1 -35.71 36.47 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.044 178.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.836 HG13 HG21 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -60.59 -50.23 81.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.561 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.82 -37.16 68.29 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.094 178.304 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -39.67 69.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.85 178.487 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.66 -25.97 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 115' ' ' VAL . 17.0 t -59.68 -53.94 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.496 176.638 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.23 -26.37 28.3 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.918 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.76 -31.03 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.918 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.73 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.95 -41.36 62.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 110.014 179.27 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.533 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 34.7 mm-40 -63.37 -34.3 77.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.879 178.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.724 ' HB1' ' HG2' ' A' ' 128' ' ' LYS . . . -76.35 -42.38 45.04 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.678 177.734 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 12.1 t-160 -68.75 -24.82 64.49 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.347 -178.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -82.84 -46.14 13.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.21 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.76 -46.81 6.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.864 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.724 ' HG2' ' HB1' ' A' ' 124' ' ' ALA . 2.0 ptpt -96.19 179.42 5.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.616 0.722 . . . . 0.0 111.642 -178.575 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.596 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 0.5 OUTLIER -90.78 53.2 2.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.04 176.198 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.575 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.0 -72.65 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.686 -176.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.07 120.48 21.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.35 -179.129 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.33 141.34 31.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.685 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -71.62 -7.32 47.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -87.69 101.9 14.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.055 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.5 p -79.87 -20.79 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.37 -166.87 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.054 -179.911 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.85 40.7 0.99 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -84.0 -38.14 21.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.959 179.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 9.2 t -96.66 18.94 13.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -86.72 61.4 4.38 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.535 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 6.8 p -79.89 131.85 62.42 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 110.925 179.751 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -63.71 171.37 7.16 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.429 2.086 . . . . 0.0 112.256 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 2.8 t -77.55 157.4 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.026 179.92 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.27 -21.07 50.48 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.654 2.236 . . . . 0.0 112.208 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.447 HD23 ' HB1' ' A' ' 120' ' ' ALA . 1.4 mp -69.93 146.76 50.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.888 -179.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.55 149.28 16.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.395 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 t -104.64 -24.2 13.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.333 . . . . 0.0 110.929 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 55.24 79.59 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.128 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.94 166.57 24.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.986 -179.824 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.52 115.07 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.026 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 56.29 79.37 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.11 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 78.7 p -132.13 127.42 20.97 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.65 170.0 21.3 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.467 2.112 . . . . 0.0 112.327 179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.32 -19.75 16.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.022 179.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.9 150.78 5.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.983 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.07 25.34 4.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.008 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.0 m -91.19 157.63 17.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -97.63 107.07 37.42 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.968 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -73.27 -78.24 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.832 2.355 . . . . 0.0 112.409 -179.28 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.23 178.29 7.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.153 -179.455 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -73.48 126.58 30.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.965 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -77.74 173.85 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.01 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -93.48 166.92 12.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.034 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -84.21 -44.64 13.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.191 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.0 -16.92 64.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.201 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.76 78.93 1.46 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.49 -26.62 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.822 0.344 . . . . 0.0 110.957 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -89.58 23.68 2.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.082 -179.846 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.482 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -72.79 -51.3 6.76 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.465 -179.83 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 27' ' ' ASN . 59.3 Cg_endo -72.05 94.87 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.083 1.855 . . . . 0.0 112.324 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.89 93.33 7.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.875 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -73.23 -78.63 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.833 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 55.81 26.8 10.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.993 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mt -80.88 -66.31 0.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.871 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -91.66 171.93 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.41 129.11 37.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.986 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.495 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 38.5 mt-30 -87.44 -50.92 0.43 Allowed Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.353 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 59.8 Cg_endo -71.83 -171.99 0.75 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.167 1.911 . . . . 0.0 112.299 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -94.74 123.11 38.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.868 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.8 t -92.56 -30.22 4.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.111 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.1 m -80.63 -16.36 54.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.935 -179.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 11.0 ttt -96.11 40.85 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.974 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -165.94 87.85 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 56.4 91.16 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.85 144.69 34.51 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.536 2.157 . . . . 0.0 112.407 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.21 87.58 7.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.135 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.703 HG23 HG13 ' A' ' 47' ' ' VAL . 2.8 m -104.98 -163.71 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.835 179.62 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.41 ' H ' ' HB ' ' A' ' 45' ' ' VAL . 1.9 m-70 -80.04 72.98 6.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.775 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.703 HG13 HG23 ' A' ' 45' ' ' VAL . 16.7 m -103.23 171.51 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.319 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -148.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.804 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -72.25 120.33 7.71 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -97.19 171.18 8.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.849 0.357 . . . . 0.0 111.204 -179.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -65.11 159.58 63.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.875 179.783 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.411 ' HA ' ' HB2' ' A' ' 51' ' ' GLU . 85.1 Cg_endo -88.55 -155.87 0.9 Allowed 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.896 -1.293 . . . . 0.0 112.703 0.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.695 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -69.29 151.79 45.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.811 179.805 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.902 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -163.03 -177.19 5.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.771 179.442 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -50.08 -38.0 36.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.066 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.1 m -61.44 -45.14 95.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.489 179.333 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.695 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -60.46 -43.38 96.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.057 178.692 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.579 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.96 -46.2 88.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.619 179.345 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.34 -9.74 58.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.109 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.3 t -80.76 -8.29 59.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.798 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.851 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -134.16 60.06 41.85 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.076 179.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.746 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 53.0 Cg_exo -52.38 -51.94 10.02 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.535 2.157 . . . . 0.0 113.131 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.3 Cg_endo -95.28 16.59 0.91 Allowed 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.451 2.101 . . . . 0.0 112.606 -179.551 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.851 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 6.5 mt-30 -126.37 -94.75 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.611 -178.852 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.774 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.01 38.54 2.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.713 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.746 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -60.26 -50.2 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.515 179.432 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -120.0 38.4 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.564 179.199 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 65.2 tt0 -127.81 -56.07 1.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.361 -179.126 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.774 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 1.2 ptt? -74.91 1.18 13.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -178.816 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.706 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -65.09 -41.52 94.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.672 -179.457 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.022 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -134.04 26.67 3.39 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.563 -179.119 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 0.0 OUTLIER -138.98 -4.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.994 0.426 . . . . 0.0 110.895 179.754 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.577 ' HB3' ' HB2' ' A' ' 69' ' ' MET . 4.5 tpm_? -126.99 -24.41 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.987 179.864 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.645 ' O ' HG12 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -74.9 -30.03 61.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.328 179.703 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.482 ' N ' HG21 ' A' ' 90' ' ' THR . 0.0 OUTLIER -40.04 -54.67 4.3 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.031 -178.089 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 75' ' ' PHE . 36.8 Cg_endo -65.27 -26.28 56.59 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.934 1.756 . . . . 0.0 112.028 178.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 53' ' ' LEU . 63.8 mt -81.57 -20.97 38.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.688 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 15.6 mm -69.53 -36.95 73.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.808 0.337 . . . . 0.0 110.112 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.685 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 1.2 mt-30 -53.41 -14.78 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 178.049 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -82.71 -40.42 20.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.698 178.702 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.25 -45.52 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.188 0.518 . . . . 0.0 110.142 179.26 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.668 ' ND1' HG11 ' A' ' 119' ' ' VAL . 9.3 m-70 -112.3 145.51 33.01 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.927 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.508 ' O ' ' HB ' ' A' ' 84' ' ' THR . 18.2 Cg_exo -30.97 -49.08 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.26 2.64 . . . . 0.0 112.456 -179.354 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.685 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 11.6 t 173.85 22.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.938 178.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -72.24 11.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.566 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.468 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -77.03 44.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.477 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -85.69 -10.7 75.77 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.332 177.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.571 ' O ' ' HG3' ' A' ' 88' ' ' LYS . 1.5 tptt -175.11 31.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.245 179.414 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.815 HG21 HG13 ' A' ' 115' ' ' VAL . 62.1 mt -79.58 -89.35 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 120.806 -0.357 . . . . 0.0 110.561 179.119 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.022 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.54 -38.57 60.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 179.241 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.47 -31.91 57.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.993 178.01 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.744 ' HG2' HG22 ' A' ' 96' ' ' ILE . 38.4 ttp -83.37 -23.14 32.57 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.717 -0.241 . . . . 0.0 110.446 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' A' ' 90' ' ' THR . 4.6 mm? -61.92 -6.18 2.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.497 178.68 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.706 HD21 HD13 ' A' ' 70' ' ' LEU . 2.0 mm? -108.99 20.84 17.96 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 176.476 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.673 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.0 pt-20 -162.52 1.72 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.473 -179.327 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.96 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.06 -152.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 121.35 0.595 . . . . 0.0 111.757 -179.9 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.549 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 2.4 t70 -59.43 -2.2 0.3 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.262 178.256 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.584 ' H ' HG12 ' A' ' 96' ' ' ILE . 5.3 m-80 78.55 -31.16 0.15 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.53 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -73.1 -29.54 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.02 0.438 . . . . 0.0 109.924 178.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.96 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.4 mt-10 -78.28 -21.84 49.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.757 177.533 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.65 HD13 ' HA ' ' A' ' 94' ' ' LEU . 1.8 tp -75.25 -25.01 57.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.902 176.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.2 mp -90.63 -46.34 8.34 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.286 -179.127 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -37.78 88.74 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.116 -178.926 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.835 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -60.86 -36.67 79.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.55 -179.657 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' HD23 ' A' ' 58' ' ' LEU . 11.6 mt -87.38 -6.03 58.63 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 110.518 179.639 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 102' ' ' LEU . 58.8 mm-40 -109.5 -13.48 14.56 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.642 -175.701 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -138.3 139.11 24.26 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -176.825 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 8.2 Cg_exo -74.24 19.55 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 112.366 179.571 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.77 -26.14 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.99 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 107' ' ' SER . 0.6 OUTLIER -62.92 -41.25 99.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.58 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.902 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.08 -28.1 1.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.964 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -96.24 -65.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.076 -179.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 31.9 t -46.95 -29.28 1.96 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.374 . . . . 0.0 110.262 179.368 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 39.3 mmtt -80.69 -42.34 22.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.723 177.784 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.815 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -64.79 -60.07 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -49.34 -40.64 36.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.864 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -73.56 -33.87 64.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.908 0.385 . . . . 0.0 110.338 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.442 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.14 -21.66 64.91 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.975 178.24 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.722 HG22 HD13 ' A' ' 89' ' ' ILE . 24.2 t -67.83 -46.15 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.738 176.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.447 ' HB1' HD23 ' A' ' 3' ' ' LEU . . . -61.45 -32.08 72.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.575 177.283 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 12.2 t -79.41 -30.81 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.614 179.166 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.627 HD22 HG12 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -74.69 -42.02 59.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.29 179.904 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.405 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 12.6 mm100 -61.18 -30.66 70.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.707 178.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.585 ' HB1' ' HG2' ' A' ' 128' ' ' LYS . . . -72.64 -52.53 15.01 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.435 177.354 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.1 -17.02 64.69 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.505 -178.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -87.4 -50.51 6.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.786 0.327 . . . . 0.0 111.021 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.86 -42.46 8.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.871 -179.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.585 ' HG2' ' HB1' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.6 175.7 6.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.599 0.714 . . . . 0.0 111.563 -178.6 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.5 63.63 5.6 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.027 176.47 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.33 -67.84 0.29 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.301 -177.272 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.44 148.34 31.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.055 179.792 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -78.68 -177.47 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -85.32 -176.73 6.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -79.27 92.82 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.028 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 5.2 m -90.54 141.91 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -75.17 -76.03 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.38 142.62 27.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.31 85.41 0.79 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.137 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.9 t -117.26 -20.75 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.99 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -94.18 -51.44 2.06 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.453 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 141' ' ' VAL . 0.6 OUTLIER -71.67 134.29 84.1 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.614 0.245 . . . . 0.0 111.099 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.8 127.96 11.26 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.492 2.128 . . . . 0.0 112.359 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 p -88.37 -66.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.164 -179.916 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.07 77.98 2.66 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.575 2.183 . . . . 0.0 112.342 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.0 tp -82.55 119.61 24.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.27 41.18 2.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.6 m -89.58 93.54 9.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.79 0.328 . . . . 0.0 110.965 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -133.16 100.01 4.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.972 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -115.44 172.17 7.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.132 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -123.23 149.42 44.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -137.64 -159.3 0.94 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.036 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 45.2 p -57.19 151.43 36.11 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.969 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -81.36 -1.0 46.13 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.471 0.312 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 89.16 0.65 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.152 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -86.15 141.49 14.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.021 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -69.76 131.26 44.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 -179.844 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.89 86.1 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.021 -179.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -102.96 132.73 20.88 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.877 179.881 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -74.75 146.22 86.12 Favored 'Cis proline' 0 C--N 1.349 0.584 0 C-N-CA 123.565 -1.431 . . . . 0.0 112.517 0.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.96 126.03 28.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 179.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.99 -178.85 5.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.78 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -78.17 139.0 38.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.905 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.64 96.71 0.28 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.04 -56.4 3.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.074 -179.838 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.65 107.13 2.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.233 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.47 -76.33 1.01 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.396 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.4 t -101.99 117.88 47.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.818 0.342 . . . . 0.0 110.953 179.657 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.458 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.6 mtm-85 -74.43 83.32 1.96 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.029 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.494 ' H ' ' HD2' ' A' ' 28' ' ' PRO . 2.1 m-20 -91.79 -51.38 0.3 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.23 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.494 ' HD2' ' H ' ' A' ' 27' ' ' ASN . 66.1 Cg_endo -73.24 98.71 1.04 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.151 1.901 . . . . 0.0 112.16 179.762 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HB2' ' H ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -91.2 -84.25 0.26 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.89 -179.714 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.552 ' HG2' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -100.25 -165.63 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.949 -179.905 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.94 15.21 0.84 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.938 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HG2' ' A' ' 30' ' ' GLN . 1.1 mp -92.6 -77.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.442 ' HA ' HG13 ' A' ' 38' ' ' VAL . 7.2 m120 -104.38 74.48 1.18 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.837 -179.98 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.13 126.56 30.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.135 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.436 ' HB3' ' HA ' ' A' ' 36' ' ' PRO . 11.5 mm100 -91.69 155.63 43.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.72 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' ' 35' ' ' GLN . 3.1 Cg_exo -76.37 -53.33 0.16 OUTLIER 'Cis proline' 0 C--N 1.348 0.515 0 C-N-CA 123.941 -1.275 . . . . 0.0 112.326 0.916 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.82 131.36 35.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.049 -179.575 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.442 HG13 ' HA ' ' A' ' 33' ' ' ASN . 1.9 t -80.76 160.67 4.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.029 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.09 34.32 2.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.963 -179.89 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.78 161.11 14.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -128.67 179.1 5.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -163.61 145.34 7.43 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.097 179.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.11 84.29 1.52 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.595 2.197 . . . . 0.0 112.267 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.25 176.42 7.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.126 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -92.49 18.47 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.091 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.19 117.71 21.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 16.2 m -101.49 -178.26 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -90.64 -179.26 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.07 119.04 4.91 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.611 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -86.33 39.56 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 111.049 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.41 -50.76 6.01 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.378 179.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.29 176.13 0.88 Allowed 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.261 1.974 . . . . 0.0 112.542 -179.519 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.589 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -69.6 136.49 51.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.016 179.624 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.879 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -169.59 -178.72 3.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.144 178.329 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.985 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.3 -33.68 29.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.424 ' HB3' ' HE1' ' A' ' 57' ' ' MET . 0.4 OUTLIER -68.7 -47.97 65.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.793 -179.885 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.459 ' HB2' ' H ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -58.09 -37.82 75.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.491 0.662 . . . . 0.0 109.749 178.431 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.985 HD12 ' HA ' ' A' ' 55' ' ' ALA . 15.7 mt -66.08 -44.15 85.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.638 179.239 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.37 -9.67 35.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.562 178.803 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 57' ' ' MET . 40.1 m -78.94 -5.8 54.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.955 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.455 ' O ' ' HG3' ' A' ' 66' ' ' GLN . . . -132.55 96.03 19.43 Favored Pre-proline 0 N--CA 1.451 -0.423 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.915 -179.291 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.607 ' O ' ' N ' ' A' ' 64' ' ' GLN . 50.6 Cg_exo -50.89 177.75 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.477 2.118 . . . . 0.0 110.263 177.002 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' C ' ' O ' ' A' ' 62' ' ' PRO . 57.5 Cg_exo -24.28 81.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.123 2.548 . . . . 0.0 112.782 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.725 ' HG2' ' HG2' ' A' ' 65' ' ' GLU . 2.9 tt0 -160.22 -83.65 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.23 -176.854 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.725 ' HG2' ' HG2' ' A' ' 64' ' ' GLN . 1.7 mm-40 -106.94 4.93 27.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.244 178.52 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.567 ' C ' HD11 ' A' ' 70' ' ' LEU . 2.3 mt-30 -57.57 -20.18 30.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.882 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.688 ' C ' HD21 ' A' ' 70' ' ' LEU . 4.8 ptmt -134.67 27.88 3.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.734 179.314 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.458 ' HB2' ' HA ' ' A' ' 65' ' ' GLU . 3.3 mm100 -135.09 -49.43 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.916 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.596 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -80.77 3.2 23.14 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -176.863 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.851 HD23 HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -75.38 -35.31 61.1 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.107 0.48 . . . . 0.0 109.862 179.375 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.081 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -129.1 26.99 4.36 Favored Glycine 0 N--CA 1.438 -1.219 0 C-N-CA 119.847 -1.168 . . . . 0.0 112.702 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -144.34 -1.25 0.94 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.763 0.316 . . . . 0.0 111.381 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.0 -22.09 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.313 0.578 . . . . 0.0 109.972 179.118 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.699 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -78.09 -23.82 47.8 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.499 178.649 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.453 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -36.74 -54.63 1.67 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.438 -178.176 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 58.4 Cg_endo -72.1 -22.05 23.13 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.034 1.823 . . . . 0.0 112.795 -179.334 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.589 HD12 ' HB2' ' A' ' 53' ' ' LEU . 94.3 mt -89.36 -19.06 25.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.888 -178.73 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.802 HG13 ' HB ' ' A' ' 90' ' ' THR . 9.8 mm -73.79 -40.11 53.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 178.086 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 84' ' ' THR . 0.0 OUTLIER -53.89 -17.09 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.858 177.351 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -79.49 -37.88 35.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.868 178.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.702 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.1 OUTLIER -72.25 -47.14 52.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.485 179.973 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 4.0 m-70 -113.33 148.97 40.74 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.622 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -56.3 79.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.433 2.088 . . . . 0.0 111.981 179.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.504 ' HA ' ' CG ' ' A' ' 79' ' ' GLN . 58.4 p 45.57 34.42 1.67 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.154 -178.483 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -89.7 6.95 39.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.016 -179.73 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -80.1 46.92 0.85 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.272 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.52 85.7 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.562 -0.828 . . . . 0.0 111.583 178.315 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.705 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -174.3 29.07 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.92 0.39 . . . . 0.0 110.702 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.933 HG21 HG13 ' A' ' 115' ' ' VAL . 65.8 mt -80.43 -93.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.406 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.081 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -50.67 -40.77 54.54 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.444 -178.925 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.08 -31.51 56.12 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.092 -1.051 . . . . 0.0 111.054 178.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.695 ' SD ' ' HB1' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -84.99 -22.75 28.98 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 120.846 0.355 . . . . 0.0 110.155 179.412 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.554 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.89 -5.78 2.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.851 HD11 HD23 ' A' ' 70' ' ' LEU . 5.1 mp -108.51 26.7 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.166 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.604 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 9.3 pt-20 -165.93 -0.21 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.314 -179.267 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.93 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.04 -152.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.366 0.603 . . . . 0.0 111.517 -179.993 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.5 t70 -59.44 -3.84 0.5 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.307 177.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.606 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.9 m-20 77.61 -28.73 0.17 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.356 -179.576 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -74.03 -26.55 60.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.93 ' HB2' HG13 ' A' ' 96' ' ' ILE . 0.4 OUTLIER -81.33 -26.49 35.57 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.454 176.985 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -74.96 -25.26 58.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.403 176.242 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.73 -48.43 8.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.214 -179.374 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.554 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -62.76 -42.32 99.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.091 -178.863 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.757 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.49 -33.63 66.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.303 -179.726 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.721 HD23 HD13 ' A' ' 58' ' ' LEU . 25.9 mt -86.76 -10.3 53.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.054 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.72 -8.92 15.29 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -176.735 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -140.72 133.38 14.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.846 -178.723 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.517 ' O ' HG21 ' A' ' 54' ' ' THR . 60.3 Cg_endo -71.4 3.71 3.41 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.595 2.196 . . . . 0.0 111.803 178.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -126.47 -11.09 6.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.742 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -79.06 -46.07 18.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.121 0.486 . . . . 0.0 109.704 177.989 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.879 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.54 -40.47 18.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.205 176.097 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 113' ' ' SER . 3.8 ttt180 -80.33 -57.33 3.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.375 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.417 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 42.1 t -53.71 -56.83 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.766 0.317 . . . . 0.0 110.799 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 7.6 mmtm -54.65 -32.81 59.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.933 HG13 HG21 ' A' ' 89' ' ' ILE . 2.1 t -72.11 -58.32 5.34 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.046 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.31 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -31.47 58.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.113 0.482 . . . . 0.0 110.29 178.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -79.95 -32.45 39.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.832 178.408 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.695 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -69.69 -20.81 63.55 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.746 177.468 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.702 HG11 ' ND1' ' A' ' 82' ' ' HIS . 21.5 t -69.48 -47.8 70.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.412 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.3 -25.58 64.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.471 177.03 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 6.2 t -86.05 -34.96 8.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.098 178.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.705 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -67.23 -33.3 75.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.203 178.254 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.58 -27.34 37.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.615 176.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.503 ' C ' ' HB3' ' A' ' 128' ' ' LYS . . . -89.02 8.65 28.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.368 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.43 ' C ' ' HG2' ' A' ' 128' ' ' LYS . 1.7 t60 -125.81 -31.86 2.88 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.158 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -89.35 -63.53 1.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.243 178.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.642 ' HB1' HG21 ' A' ' 139' ' ' THR . . . -95.24 17.03 15.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.055 -177.98 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.661 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 7.6 ptmt -71.25 -147.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.928 0.394 . . . . 0.0 110.563 178.854 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -81.07 10.31 5.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.406 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.661 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -58.3 -22.01 51.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.376 -178.886 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -83.77 -170.38 3.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.06 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -71.07 -76.73 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.059 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.73 ' HB3' HG23 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.48 119.67 11.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.826 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -86.84 41.54 0.97 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.181 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.73 HG23 ' HB3' ' A' ' 133' ' ' LYS . 0.2 OUTLIER -99.15 166.17 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.972 179.737 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -92.39 62.86 4.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.95 173.27 6.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.98 -179.757 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.91 141.19 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.043 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.642 HG21 ' HB1' ' A' ' 127' ' ' ALA . 13.5 p -100.83 159.93 14.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.034 -179.874 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -85.61 99.15 2.34 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.543 -179.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.612 ' H ' ' HD2' ' A' ' 142' ' ' PRO . 3.0 t -97.17 -51.81 0.22 Allowed Pre-proline 0 C--N 1.329 -0.298 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -179.838 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.612 ' HD2' ' H ' ' A' ' 141' ' ' VAL . 49.8 Cg_endo -68.68 165.98 27.63 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.153 1.902 . . . . 0.0 112.351 -179.896 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.9 t -104.42 144.49 31.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.948 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.087 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.53 -57.03 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.506 2.137 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.59 -75.4 0.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.901 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -106.9 178.16 22.06 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.546 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -97.35 -36.31 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.748 0.308 . . . . 0.0 110.912 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.21 116.23 28.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.986 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.6 142.25 16.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.087 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 58.45 -165.56 0.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.127 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 130.22 39.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 -179.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.707 ' N ' ' HA ' ' A' ' 11' ' ' PRO . 0.3 OUTLIER -81.08 -49.02 1.05 Allowed Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.744 -179.881 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.707 ' HA ' ' N ' ' A' ' 10' ' ' THR . 80.8 Cg_endo -88.49 168.77 36.61 Favored 'Cis proline' 0 C--N 1.357 1.001 0 C-N-CA 124.551 -1.021 . . . . 0.0 112.662 0.835 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.29 -59.01 2.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.149 180.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.423 HG22 ' H ' ' A' ' 13' ' ' VAL . 1.6 m -83.5 102.34 9.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.132 -179.907 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -98.64 125.28 43.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.838 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.0 118.04 33.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.011 -179.832 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.731 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 0.3 OUTLIER -99.88 -46.97 0.21 Allowed Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.682 -179.901 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.731 ' HD2' ' H ' ' A' ' 16' ' ' VAL . 19.8 Cg_endo -60.52 -55.43 1.47 Allowed 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.921 1.747 . . . . 0.0 112.487 -179.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.95 73.05 10.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.912 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -78.7 144.28 35.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.901 179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -73.91 143.95 45.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -89.25 83.12 6.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.7 -13.27 27.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.062 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.15 9.42 20.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.045 179.907 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.31 110.55 4.04 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.492 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.79 128.77 65.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.768 0.318 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.53 99.96 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.976 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -95.12 141.75 23.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.834 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.47 -15.71 31.74 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.626 2.217 . . . . 0.0 112.315 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.67 51.55 2.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.569 ' HB3' HD23 ' A' ' 32' ' ' LEU . 6.3 mm100 -82.01 -42.77 18.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.823 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 55.74 57.9 4.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.093 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 30' ' ' GLN . 0.2 OUTLIER -90.99 88.88 7.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.786 179.7 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -97.58 -166.02 1.33 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.05 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.11 108.17 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.227 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.407 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 5.1 tt0 -106.46 93.3 8.13 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.794 179.522 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.42 ' HB2' HE21 ' A' ' 37' ' ' GLN . 30.1 Cg_endo -63.05 -69.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.463 2.109 . . . . 0.0 112.204 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 36' ' ' PRO . 11.1 mm-40 -101.53 -178.28 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.934 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.8 p -81.71 -26.46 9.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.93 100.3 12.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.976 179.955 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.5 36.95 2.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 38.95 40.42 0.45 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.556 -179.801 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -91.86 152.72 43.31 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.871 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -90.95 115.24 2.48 Favored 'Cis proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.756 -1.352 . . . . 0.0 112.429 0.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -86.83 65.11 8.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.981 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.437 ' HB ' HG12 ' A' ' 47' ' ' VAL . 8.3 m -88.09 150.43 3.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.157 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -107.84 7.78 28.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.437 HG12 ' HB ' ' A' ' 45' ' ' VAL . 8.1 p -89.94 141.66 14.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.954 179.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 151.05 31.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 179.996 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -74.25 120.0 6.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.47 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -102.55 138.51 39.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.608 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -69.61 -49.74 20.71 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.414 179.659 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.608 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 20.6 Cg_endo -60.3 147.14 94.84 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.204 1.936 . . . . 0.0 112.234 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.775 ' HB2' ' HG ' ' A' ' 77' ' ' LEU . 0.2 OUTLIER -92.13 136.08 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.976 -179.561 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.861 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.98 -175.36 1.21 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.647 178.585 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.49 ' HA ' ' CD2' ' A' ' 58' ' ' LEU . . . -50.34 -45.77 55.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.591 -179.687 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.7 m -55.9 -45.45 78.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.8 0.333 . . . . 0.0 110.718 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.495 ' HE2' ' H ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -60.29 -42.91 96.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.377 178.964 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.68 -46.9 86.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.338 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.46 -9.48 53.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.026 179.65 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 57' ' ' MET . 35.2 t -82.22 -9.17 59.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.003 -179.615 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.876 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.98 58.52 32.18 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.419 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.595 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.1 Cg_exo -54.07 -49.84 15.7 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.531 2.154 . . . . 0.0 113.286 -179.482 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.513 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 76.5 Cg_endo -87.23 -8.05 6.66 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.151 1.901 . . . . 0.0 112.768 -179.117 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.876 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -97.0 -79.3 0.46 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.168 -179.472 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -104.92 -93.98 0.35 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.033 -179.507 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.595 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER 74.99 -47.99 0.63 Allowed 'General case' 0 N--CA 1.465 0.285 0 O-C-N 123.524 0.515 . . . . 0.0 111.142 -179.108 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.629 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -127.15 26.33 6.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.032 179.686 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.489 ' N ' HD21 ' A' ' 70' ' ' LEU . 2.6 tt0 -128.34 -53.28 1.28 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.456 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -78.58 20.5 0.43 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.155 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.822 HD13 HD21 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -89.65 -53.43 4.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.168 0.508 . . . . 0.0 110.385 179.698 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.074 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -108.32 18.66 32.85 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.379 -0.915 . . . . 0.0 111.775 178.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.78 -10.59 2.07 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.338 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.549 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -126.55 -15.38 5.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.571 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.726 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -78.13 -12.67 60.01 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.526 179.968 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 10.4 t80 -49.64 -54.55 30.13 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.768 -177.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 26.3 Cg_exo -63.27 -7.88 13.16 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.139 1.892 . . . . 0.0 112.329 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.775 ' HG ' ' HB2' ' A' ' 53' ' ' LEU . 2.1 mm? -98.63 -37.46 9.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.65 -179.178 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.597 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.5 mm -61.1 -42.46 93.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-O 120.717 0.294 . . . . 0.0 110.942 -179.626 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.8 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 7.3 mt-30 -48.88 -18.79 0.31 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.956 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.49 -40.14 18.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.255 179.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.479 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -72.53 -35.47 68.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.347 0.594 . . . . 0.0 110.601 179.674 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.706 ' CE1' HG21 ' A' ' 119' ' ' VAL . 7.2 m170 -121.61 157.44 56.75 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.649 -177.037 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.501 ' HD2' HD13 ' A' ' 85' ' ' LEU . 16.3 Cg_exo -67.29 69.08 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.488 2.126 . . . . 0.0 111.586 179.031 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.8 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 0.5 OUTLIER 52.41 24.2 2.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.753 -178.252 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.501 HD13 ' HD2' ' A' ' 83' ' ' PRO . 0.0 OUTLIER -76.93 1.97 16.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.168 -179.33 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.39 -135.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.232 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.76 -17.24 11.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.97 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.953 ' HE2' ' HB2' ' A' ' 122' ' ' LEU . 0.1 OUTLIER -155.88 -20.98 0.11 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.846 HG21 HG13 ' A' ' 115' ' ' VAL . 61.2 mt -50.17 -80.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 CA-C-N 117.706 0.23 . . . . 0.0 111.397 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.074 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.1 -40.22 67.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.557 0.217 . . . . 0.0 110.88 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -57.95 -28.77 61.22 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.581 176.836 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.645 ' HE3' ' HB1' ' A' ' 118' ' ' ALA . 3.3 ttm -75.65 -37.0 60.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 121.474 0.654 . . . . 0.0 109.83 177.35 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.717 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -56.06 -9.63 0.66 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.72 -178.265 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.611 HD13 ' HA3' ' A' ' 71' ' ' GLY . 4.7 mp -105.24 27.09 8.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.363 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.8 pt-20 -170.19 1.26 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.758 -178.477 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.982 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.99 -148.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 121.436 0.636 . . . . 0.0 111.42 -179.768 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 96' ' ' ILE . 3.3 t70 -54.38 -9.82 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.799 175.929 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.702 ' H ' HG12 ' A' ' 96' ' ' ILE . 1.6 m120 79.43 -24.1 0.22 Allowed 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.41 -0.813 . . . . 0.0 111.164 -179.696 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -75.51 -28.47 59.15 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.982 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mp0 -74.42 -33.91 63.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.007 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.3 -27.73 68.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.194 178.445 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.602 HD12 HD23 ' A' ' 101' ' ' LEU . 2.7 mp -85.58 -48.33 9.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -39.06 90.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.501 -178.527 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.866 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -57.45 -37.49 72.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.37 -179.365 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.822 HD21 HD13 ' A' ' 70' ' ' LEU . 6.6 mt -87.5 -8.52 56.31 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.115 0.483 . . . . 0.0 110.293 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -106.47 -8.4 17.12 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.267 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.791 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.4 OUTLIER -143.95 133.48 11.61 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.63 0.252 . . . . 0.0 111.557 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.499 ' O ' HG21 ' A' ' 54' ' ' THR . 51.2 Cg_endo -69.29 3.44 2.54 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.692 2.261 . . . . 0.0 112.207 179.46 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.17 -26.0 3.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.23 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.6 OUTLIER -63.76 -44.1 94.44 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.223 179.743 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.866 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -47.43 -41.24 19.8 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.471 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 112' ' ' ARG . 1.6 ttt180 -79.09 -64.15 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 t -49.18 -54.07 18.2 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.717 0.294 . . . . 0.0 111.134 -178.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.427 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 5.4 mmtt -59.38 -28.95 67.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.091 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.846 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -71.85 -58.41 5.17 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 178.142 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.433 ' N ' HG12 ' A' ' 115' ' ' VAL . 3.8 t70 -51.24 -36.69 43.09 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.864 0.364 . . . . 0.0 110.869 178.089 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.74 -40.17 69.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.477 179.015 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.645 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -62.39 -29.82 70.76 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.706 HG21 ' CE1' ' A' ' 82' ' ' HIS . 22.4 t -55.49 -50.62 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-O 121.387 0.613 . . . . 0.0 109.822 177.387 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.51 -29.16 34.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.763 177.442 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.484 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 12.3 t -84.6 -31.65 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.898 179.13 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.953 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -69.36 -43.17 74.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.958 179.503 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.503 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.3 mm-40 -65.37 -30.33 71.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.887 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.469 ' HA ' ' HD2' ' A' ' 128' ' ' LYS . . . -88.65 -1.45 58.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.315 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.484 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 12.2 t-80 -120.68 -9.73 9.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.64 -178.675 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -65.14 -105.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.929 -179.354 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.3 36.05 1.27 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 111.152 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -96.16 -152.63 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.067 -179.773 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.86 8.23 13.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.79 179.826 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.424 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . . . -88.62 2.01 53.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.914 179.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -88.68 100.23 12.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.989 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.446 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.5 OUTLIER -82.83 78.18 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.862 -179.75 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.02 -65.48 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.872 179.845 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.53 91.61 4.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.069 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.0 t -73.93 132.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.073 -179.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -92.21 -58.35 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.853 179.799 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 2.7 m -88.27 113.94 24.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.664 179.486 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.65 86.95 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 102.14 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -80.67 -14.31 80.03 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.555 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.5 130.8 32.52 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 120.607 0.242 . . . . 0.0 111.006 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.59 71.45 5.98 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.456 2.104 . . . . 0.0 112.344 -179.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 2.5 t -97.89 -34.53 10.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.985 -179.674 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.987 -179.872 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.46 121.89 9.05 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.529 2.153 . . . . 0.0 112.188 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.492 ' H ' ' HG ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -98.52 49.21 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.861 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.88 -173.56 24.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.456 179.824 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -79.21 161.37 26.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.774 0.321 . . . . 0.0 110.968 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.3 123.4 23.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.144 -179.902 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.53 17.89 0.54 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.023 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -139.03 9.16 2.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -130.91 -70.76 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.13 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m 57.52 91.18 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.169 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.72 111.13 2.93 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.461 2.107 . . . . 0.0 112.278 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.63 -49.9 9.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.7 m -89.41 162.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.106 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.09 122.73 23.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 52.1 p -90.31 122.36 33.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.1 t -94.14 130.21 34.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.951 179.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.23 -179.21 1.36 Allowed 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.534 2.156 . . . . 0.0 112.249 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.78 135.02 38.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.008 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -148.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.65 179.592 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -162.71 0.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.745 0.307 . . . . 0.0 110.853 179.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -63.7 97.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.942 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.91 -169.52 1.89 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.174 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.47 167.27 21.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.86 68.4 2.56 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.515 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.8 m -100.39 77.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.964 0.412 . . . . 0.0 111.114 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 137.53 52.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.997 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.688 ' N ' ' HA ' ' A' ' 28' ' ' PRO . 0.6 OUTLIER -74.09 -49.81 5.49 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.602 179.934 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.688 ' HA ' ' N ' ' A' ' 27' ' ' ASN . 92.0 Cg_endo -90.13 -44.91 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 124.571 -1.012 . . . . 0.0 112.843 0.665 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -79.82 140.64 36.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.22 164.83 24.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -123.1 46.58 2.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.981 -179.737 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.66 -16.18 20.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.886 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -82.03 -164.96 0.88 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.89 -167.49 0.2 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.743 ' H ' ' HA ' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -90.7 -50.95 0.33 Allowed Pre-proline 0 CA--C 1.536 0.433 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.612 -179.818 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.743 ' HA ' ' H ' ' A' ' 35' ' ' GLN . 67.7 Cg_endo -94.27 -163.97 1.26 Allowed 'Cis proline' 0 C--N 1.355 0.888 0 C-N-CA 124.723 -0.949 . . . . 0.0 112.684 0.658 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -71.01 126.65 30.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.977 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.9 t -76.51 90.62 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.029 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.82 103.14 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 179.98 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -89.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.998 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 112.99 2.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.028 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -64.84 146.62 98.61 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.019 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.29 86.66 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.0 112.233 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.56 145.59 36.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.143 -179.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 t -98.67 81.72 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.067 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -107.92 0.56 22.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.927 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.94 155.84 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.017 -179.917 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.24 35.0 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -77.03 -30.64 55.23 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.496 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -105.83 149.01 26.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.99 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -73.28 124.46 90.56 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.031 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' MET . 34.3 Cg_exo -62.25 150.4 87.12 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.684 2.256 . . . . 0.0 112.399 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.671 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -72.14 135.94 46.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.121 179.725 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.869 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -172.42 -178.2 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.325 178.026 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.939 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.19 -38.39 39.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.645 -179.134 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.684 ' HB2' ' HE1' ' A' ' 57' ' ' MET . 1.0 OUTLIER -64.1 -48.91 74.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.843 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.684 ' HE1' ' HB2' ' A' ' 56' ' ' SER . 0.0 OUTLIER -58.13 -40.23 80.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.296 0.569 . . . . 0.0 110.357 179.377 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.939 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.3 mt -64.08 -45.0 90.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.98 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.82 -7.66 29.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.567 178.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.444 ' HB3' ' O ' ' A' ' 57' ' ' MET . 21.5 t -83.77 -5.23 59.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.768 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.58 ' HB1' ' H ' ' A' ' 65' ' ' GLU . . . -133.05 56.85 23.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.353 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.623 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 51.5 Cg_exo -54.56 -52.65 7.65 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.432 2.088 . . . . 0.0 113.225 -179.082 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 66.7 Cg_endo -96.15 21.91 0.42 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.501 2.134 . . . . 0.0 112.544 -179.329 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.556 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 23.5 mt-30 -130.72 -98.0 0.33 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.629 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.665 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -104.6 38.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.676 -177.964 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.608 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -66.54 -30.68 71.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.297 178.594 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.729 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -129.92 40.21 3.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.407 179.3 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.418 ' N ' HD21 ' A' ' 70' ' ' LEU . 52.0 tt0 -138.01 -52.71 0.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.972 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.665 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 3.7 ptt? -81.7 6.52 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -176.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 1.034 ' HB2' HD11 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -63.05 -59.08 5.28 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.257 0.551 . . . . 0.0 110.2 -179.82 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.011 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -116.91 32.53 5.44 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.201 -1.0 . . . . 0.0 112.697 -179.183 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -141.09 -1.06 1.4 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.733 0.301 . . . . 0.0 111.27 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -127.26 -23.04 3.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.092 0.472 . . . . 0.0 110.057 179.343 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.708 ' CD1' HD11 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -76.5 -22.42 54.5 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.663 178.62 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -40.09 -55.26 4.02 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.241 -177.952 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 59.5 Cg_endo -72.4 -16.04 27.8 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.04 1.826 . . . . 0.0 112.596 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.671 HD12 ' HB2' ' A' ' 53' ' ' LEU . 50.6 mt -92.84 -21.1 20.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.603 -179.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.74 HG13 ' HB ' ' A' ' 90' ' ' THR . 10.3 mm -73.15 -38.94 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.743 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 0.2 OUTLIER -52.08 -17.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.04 177.724 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -78.17 -39.38 41.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.864 178.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.689 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.3 OUTLIER -71.42 -45.01 63.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.538 -179.96 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 85' ' ' LEU . 5.4 m-70 -115.45 139.95 25.28 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.382 -179.979 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -50.5 82.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.53 2.154 . . . . 0.0 112.147 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.743 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 73.5 p 43.72 40.04 2.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.163 -178.837 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -97.17 6.28 48.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.183 -179.477 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -81.07 56.31 2.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.106 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.91 -8.56 75.83 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.151 177.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.634 ' HB3' HD13 ' A' ' 122' ' ' LEU . 1.2 tptt -177.65 31.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.394 179.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.882 HG21 HG13 ' A' ' 115' ' ' VAL . 80.9 mt -79.66 -89.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.981 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.011 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.5 OUTLIER -51.66 -42.46 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.448 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -54.47 -30.65 50.32 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.014 -1.089 . . . . 0.0 110.919 178.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.638 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -83.8 -23.58 31.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.452 -0.374 . . . . 0.0 110.199 178.941 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.57 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.2 mm? -60.72 -10.61 5.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.91 179.052 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.034 HD11 ' HB2' ' A' ' 70' ' ' LEU . 6.5 mp -105.68 27.17 8.7 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 176.755 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.638 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -166.03 -0.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.699 -178.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 1.016 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.44 -150.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.508 0.67 . . . . 0.0 111.727 -179.389 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.606 ' N ' HG12 ' A' ' 96' ' ' ILE . 4.4 t70 -55.09 -8.43 0.28 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.851 175.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.764 ' H ' HG12 ' A' ' 96' ' ' ILE . 0.0 OUTLIER 80.08 -31.13 0.13 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.942 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -67.94 -29.17 68.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.834 178.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 1.016 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -76.08 -34.96 59.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.757 177.255 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.752 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -64.62 -30.15 71.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.913 178.263 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.67 -47.75 11.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.362 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 0.0 OUTLIER -64.79 -42.2 95.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.494 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.75 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -56.17 -34.9 66.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.505 -179.123 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.677 ' CD2' HD13 ' A' ' 58' ' ' LEU . 12.8 mt -85.84 -11.04 54.39 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.937 -179.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 1.5 pt-20 -109.53 -4.83 15.99 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 0.6 OUTLIER -143.56 133.52 11.92 Favored Pre-proline 0 C--N 1.331 -0.207 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.948 -179.245 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 54' ' ' THR . 12.8 Cg_exo -70.73 1.13 5.38 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.98 2.453 . . . . 0.0 111.946 179.316 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.551 ' O ' ' HB2' ' A' ' 113' ' ' SER . 76.7 mt-10 -125.56 -11.48 6.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.537 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.4 OUTLIER -78.04 -44.98 24.88 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.142 0.496 . . . . 0.0 109.733 177.908 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.869 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.77 -41.92 24.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.25 176.07 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.66 -61.14 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.551 -179.499 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.551 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.96 -53.23 20.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.809 0.338 . . . . 0.0 111.224 -178.895 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.68 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 71.4 mmtt -60.59 -29.74 69.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.018 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.882 HG13 HG21 ' A' ' 89' ' ' ILE . 1.2 t -71.81 -56.01 11.65 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.253 178.774 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.428 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -53.88 -35.36 61.49 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 110.512 178.761 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -38.88 63.29 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.28 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.36 -22.56 66.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.759 HG11 ' ND1' ' A' ' 82' ' ' HIS . 19.1 t -68.37 -49.01 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 CA-C-O 121.084 0.469 . . . . 0.0 109.831 177.022 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.46 -27.17 65.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.389 177.149 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 8.5 t -83.88 -30.8 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.464 179.097 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -76.07 -33.52 59.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.824 178.804 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -67.54 -33.43 75.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.862 178.442 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 128' ' ' LYS . . . -77.48 -76.62 0.17 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.549 177.8 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.414 ' CA ' ' HG2' ' A' ' 128' ' ' LYS . 0.4 OUTLIER -29.34 -39.77 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.91 0.756 . . . . 0.0 112.47 -177.836 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 124' ' ' ALA . 24.9 mm100 -64.57 -80.3 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.292 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.39 30.35 2.57 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.371 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.878 ' HG3' ' H ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -96.14 -158.31 0.65 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 0.0 111.043 178.793 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.71 20.58 2.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.582 177.161 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.878 ' H ' ' HG3' ' A' ' 128' ' ' LYS . . . -60.65 -32.72 71.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.208 -178.474 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.31 100.35 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.272 -179.373 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.45 ' HG3' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -97.61 34.99 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.666 179.515 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.34 172.81 1.78 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.12 -179.866 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -85.5 -166.91 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 17.0 m -75.35 155.31 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.14 -179.905 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.426 ' HB3' ' H ' ' A' ' 137' ' ' SER . 9.3 m-80 -84.14 -111.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.789 -179.99 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.426 ' H ' ' HB3' ' A' ' 136' ' ' ASN . 0.3 OUTLIER -103.9 114.08 28.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.804 0.335 . . . . 0.0 110.892 179.973 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -75.86 151.27 37.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.054 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 5.7 t -88.54 148.68 24.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.932 179.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -103.61 -151.09 22.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.8 m -84.55 146.49 47.16 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.466 0.174 . . . . 0.0 111.126 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 144' ' ' VAL . 88.6 Cg_endo -80.82 178.9 30.35 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.443 -1.482 . . . . 0.0 112.445 0.126 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.11 14.55 29.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.925 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.574 HG22 ' HB2' ' A' ' 142' ' ' PRO . 6.1 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.045 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -60.3 159.7 25.93 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.668 2.245 . . . . 0.0 112.195 -179.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.5 110.72 22.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.931 179.889 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.1 -161.99 27.64 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.482 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.43 21.44 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.799 0.333 . . . . 0.0 111.119 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.07 -160.07 0.24 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.148 179.841 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.55 -2.4 0.14 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.234 -179.815 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.72 -59.29 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.151 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 59.92 -172.69 0.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.19 -179.729 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.58 135.05 26.93 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.038 -179.82 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 100.18 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.665 2.243 . . . . 0.0 112.212 -179.906 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.7 7.71 16.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.082 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -90.78 139.88 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 -179.88 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.32 104.17 10.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.905 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.7 p -104.56 95.92 6.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.021 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.41 109.69 45.89 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.825 179.674 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.7 101.94 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.638 2.225 . . . . 0.0 112.373 -179.489 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -96.35 62.74 2.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.762 179.594 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -69.55 -163.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.194 -179.563 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -72.2 164.18 26.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.999 -179.794 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -90.12 -15.8 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.923 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.05 -74.69 0.25 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.105 -179.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.9 55.78 3.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.069 -179.95 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.42 -63.29 0.69 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.582 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.34 97.55 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 111.097 179.922 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.0 tpt85 -91.89 -11.69 35.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 179.844 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.419 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 3.2 p30 -94.87 131.74 29.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 179.884 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 27' ' ' ASN . 27.1 Cg_exo -62.35 -14.18 37.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.715 2.277 . . . . 0.0 112.198 -179.717 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -77.79 103.05 7.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.92 -179.904 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -99.66 -14.15 19.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.946 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 55.74 44.91 25.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.809 -179.906 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mt -85.77 160.74 19.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.879 179.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -101.99 160.58 14.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.906 -179.843 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 128.44 35.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 -179.873 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -99.98 140.48 21.55 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.995 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.04 -10.59 15.19 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.202 . . . . 0.0 112.288 179.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -80.78 -165.65 0.94 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.574 HG12 ' H ' ' A' ' 40' ' ' MET . 2.1 t -77.89 138.88 19.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.097 -179.777 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.71 -6.75 51.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.901 -179.948 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.574 ' H ' HG12 ' A' ' 38' ' ' VAL . 2.9 ttt -89.61 90.57 8.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.87 127.48 56.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.975 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.555 ' H ' ' HD2' ' A' ' 43' ' ' PRO . 60.5 mt-30 -93.76 -51.26 0.26 Allowed Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.397 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.555 ' HD2' ' H ' ' A' ' 42' ' ' GLN . 57.9 Cg_endo -70.83 86.27 0.74 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.119 1.88 . . . . 0.0 112.356 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.19 134.03 38.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -86.82 13.34 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -98.75 -7.52 27.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.971 179.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.0 t -107.03 39.12 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.971 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -87.22 8.93 21.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.916 179.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -90.41 18.9 46.88 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.436 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -97.23 138.11 35.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.806 0.336 . . . . 0.0 110.999 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 15.3 mt-10 -85.31 130.67 50.79 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 51' ' ' GLU . 32.5 Cg_exo -59.66 128.81 28.32 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.558 2.172 . . . . 0.0 112.211 -179.988 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -81.72 136.26 35.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.816 179.844 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.775 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -167.83 179.37 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.372 179.521 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.625 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -46.5 -44.51 17.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.664 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -46.64 82.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.729 179.921 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.509 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.09 -42.36 85.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.898 178.565 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.556 HD22 ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -61.12 -42.23 98.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.417 178.583 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -17.29 48.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.507 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.9 t -69.7 -22.05 63.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.117 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.895 ' HB3' ' HG2' ' A' ' 65' ' ' GLU . . . -133.17 65.93 74.3 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.838 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.627 ' HA ' ' HG3' ' A' ' 66' ' ' GLN . 50.9 Cg_exo -53.56 -52.36 8.75 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.652 2.235 . . . . 0.0 113.204 -178.668 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.617 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 63.4 Cg_endo -96.34 23.02 0.36 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.506 2.138 . . . . 0.0 112.451 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.883 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 15.9 mm-40 -132.29 -88.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.878 -178.455 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.895 ' HG2' ' HB3' ' A' ' 61' ' ' ALA . 1.1 pt-20 -106.92 33.56 3.89 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.983 0.421 . . . . 0.0 111.682 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.627 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -75.71 -27.82 58.36 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.028 179.318 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.558 ' CA ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -126.85 31.01 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 -179.607 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.516 ' N ' HD21 ' A' ' 70' ' ' LEU . 30.2 tt0 -132.46 -55.93 0.96 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.712 -179.523 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.816 ' HG2' ' HG3' ' A' ' 65' ' ' GLU . 2.8 ptt? -80.9 28.12 0.36 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.563 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -89.87 -47.38 7.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.24 0.543 . . . . 0.0 109.956 178.834 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.043 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -110.79 12.62 29.78 Favored Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 177.658 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -127.51 0.53 6.24 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.734 ' HB2' ' HB2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -126.49 -31.56 2.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.787 -0.188 . . . . 0.0 111.325 -179.706 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.849 HD22 HD12 ' A' ' 53' ' ' LEU . 2.9 mm? -57.62 -27.15 62.52 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.127 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.478 ' HB3' ' CD ' ' A' ' 76' ' ' PRO . 9.2 t80 -38.41 -62.12 0.75 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.003 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.656 ' HG2' HD22 ' A' ' 77' ' ' LEU . 30.0 Cg_endo -62.19 -14.81 40.29 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.897 1.731 . . . . 0.0 112.312 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.709 ' HG ' ' H ' ' A' ' 53' ' ' LEU . 2.1 mm? -96.73 -25.99 15.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.866 -178.685 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' A' ' 74' ' ' LEU . 7.3 mm -70.88 -46.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 CA-C-O 120.845 0.355 . . . . 0.0 110.758 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.944 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 21.4 mt-30 -50.11 -19.22 0.7 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.543 178.876 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.61 -37.71 27.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.961 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.5 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -74.87 -37.27 62.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.757 -179.838 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 3.1 m-70 -124.49 150.62 65.19 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.605 -179.526 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.27 79.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.438 2.092 . . . . 0.0 111.641 179.036 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.944 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 13.1 t 40.35 36.62 0.36 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.368 -178.3 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 1.0 OUTLIER -86.13 2.63 45.99 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.072 -179.87 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.588 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.75 -141.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.403 ' N ' ' HE1' ' A' ' 75' ' ' PHE . . . 80.66 -7.16 59.22 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.816 -179.132 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.656 ' HB3' HD13 ' A' ' 122' ' ' LEU . 0.8 OUTLIER -161.98 -25.24 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.748 -0.226 . . . . 0.0 111.527 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.764 HG21 HG13 ' A' ' 115' ' ' VAL . 61.8 mt -49.14 -81.97 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -178.39 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.043 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.3 OUTLIER -56.74 -37.21 70.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.821 -179.828 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.72 -28.33 56.69 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 177.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.583 ' SD ' ' HE2' ' A' ' 88' ' ' LYS . 2.1 ttp -77.23 -34.67 55.93 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.33 0.586 . . . . 0.0 109.797 177.17 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.726 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.5 mm? -58.27 -9.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.591 -178.264 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.476 HD23 ' HA3' ' A' ' 71' ' ' GLY . 1.5 mm? -104.31 26.75 8.51 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.751 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -171.36 1.03 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.031 -178.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.999 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.66 -148.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.466 0.651 . . . . 0.0 111.696 -179.239 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.605 ' N ' HG12 ' A' ' 96' ' ' ILE . 12.6 t0 -54.24 -9.67 0.3 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.863 176.167 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.691 ' H ' HG12 ' A' ' 96' ' ' ILE . 2.7 m120 79.66 -22.07 0.3 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -78.29 -25.33 46.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.058 0.456 . . . . 0.0 109.791 177.407 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.999 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -78.72 -25.44 44.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.817 177.327 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.702 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 1.9 tp -74.66 -27.24 60.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.094 178.491 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.48 -45.67 9.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.829 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.408 ' O ' ' OG ' ' A' ' 110' ' ' SER . 1.7 t-80 -62.85 -47.03 85.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.166 -178.92 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.877 ' HB2' HD22 ' A' ' 111' ' ' LEU . 7.1 ptm -52.59 -35.71 54.74 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.536 -178.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.73 HD21 HD13 ' A' ' 70' ' ' LEU . 25.1 mt -83.57 -11.92 56.75 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.963 -178.695 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -108.33 -11.56 15.18 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.715 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.478 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.3 OUTLIER -140.15 137.05 17.53 Favored Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.981 -178.941 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 107' ' ' SER . 6.5 Cg_exo -73.63 2.22 6.07 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.941 2.427 . . . . 0.0 111.923 179.433 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -121.42 -16.01 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.546 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.478 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 3.3 p -74.66 -51.22 14.98 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.007 0.432 . . . . 0.0 109.859 178.612 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.877 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.1 OUTLIER -46.78 -38.77 10.61 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.319 177.429 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.412 ' HA ' ' HE1' ' A' ' 81' ' ' MET . 16.1 ttt180 -81.05 -65.42 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.242 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.411 ' N ' ' HG2' ' A' ' 112' ' ' ARG . 74.9 m -47.63 -54.5 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.785 0.326 . . . . 0.0 111.22 -178.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.428 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 9.0 mmtt -58.89 -33.06 70.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.132 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.764 HG13 HG21 ' A' ' 89' ' ' ILE . 1.3 t -70.61 -55.03 15.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -40.1 60.63 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.89 178.174 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -73.58 -34.9 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.24 178.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 121' ' ' VAL . . . -66.6 -24.15 66.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.961 178.016 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.9 t -63.5 -51.46 70.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 176.61 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.6 -24.67 34.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.538 176.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 118' ' ' ALA . 34.7 t -84.63 -32.83 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.924 179.489 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.656 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -72.71 -44.23 62.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.023 179.294 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.551 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 51.0 mm-40 -63.73 -29.5 70.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.986 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.612 ' HB1' ' HE3' ' A' ' 128' ' ' LYS . . . -75.78 -50.74 14.36 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.949 178.276 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -69.15 -18.5 63.95 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.722 -178.289 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -87.65 -45.96 9.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.826 0.346 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.85 -47.43 6.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.731 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.612 ' HE3' ' HB1' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -96.13 178.89 5.25 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.708 0.766 . . . . 0.0 111.754 -178.199 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 128' ' ' LYS . 3.7 pt-20 -90.49 61.82 5.06 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.924 175.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.464 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -57.63 -23.27 50.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.503 -177.209 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.76 99.03 6.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.98 179.6 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -78.71 -179.73 6.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -89.71 44.42 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.054 179.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.08 172.86 7.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 25.2 m -80.48 -169.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.059 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.89 150.58 48.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 179.726 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.91 178.58 6.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.84 77.35 8.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.165 179.959 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.79 -51.69 2.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.946 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -105.08 79.05 0.28 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 4.9 p -94.19 131.22 31.93 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.593 0.235 . . . . 0.0 111.041 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.19 103.63 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.476 2.117 . . . . 0.0 112.258 -179.807 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.56 108.38 19.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 -179.97 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 10.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.086 179.921 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.67 -78.78 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.529 2.152 . . . . 0.0 112.316 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp -100.07 -30.81 11.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.87 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.2 111.68 3.56 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.453 -179.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -102.3 41.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.821 0.343 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.81 -167.54 0.13 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.227 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.38 -54.19 4.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.07 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.08 -169.95 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.86 -175.97 3.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.064 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.56 94.03 26.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.901 179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -68.77 127.37 15.29 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.427 2.085 . . . . 0.0 112.26 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.7 -25.99 14.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.912 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.4 111.97 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -100.17 136.86 39.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.999 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t -109.03 137.53 46.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 p -116.7 129.13 25.51 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.56 176.61 35.32 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.959 -1.267 . . . . 0.0 112.16 0.525 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -100.03 75.59 1.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.727 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -69.07 -23.76 64.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.17 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.14 158.94 15.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.083 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.53 93.58 9.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.788 179.83 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.15 -65.26 1.02 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.067 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.33 131.34 41.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.166 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.03 46.86 3.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.398 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.16 179.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.862 0.363 . . . . 0.0 110.995 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -91.04 -71.19 0.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.859 179.984 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -92.6 131.0 35.12 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.843 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.09 -49.03 17.88 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.557 2.171 . . . . 0.0 112.302 -179.818 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -95.75 81.54 3.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.875 -179.973 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.403 ' HB3' ' H ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -92.35 -81.71 0.34 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.68 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.403 ' H ' ' HB3' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -118.91 -12.31 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.965 -179.88 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -76.55 123.76 26.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.965 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.59 142.03 30.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.01 -179.992 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.59 -173.89 3.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.145 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.413 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 0.5 OUTLIER -96.32 108.07 39.51 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.753 179.871 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 33.0 Cg_endo -63.93 128.19 21.32 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.489 2.126 . . . . 0.0 112.3 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.69 -171.55 2.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.055 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -77.39 -14.24 14.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.7 60.09 5.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.838 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 36.4 mmm -88.72 -169.94 2.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 -179.846 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.92 126.86 30.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.991 -179.759 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.421 ' HA ' ' C ' ' A' ' 43' ' ' PRO . 7.7 pt20 -153.65 130.66 5.83 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 179.752 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.421 ' C ' ' HA ' ' A' ' 42' ' ' GLN . 15.2 Cg_exo -69.69 143.88 74.97 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.748 -1.355 . . . . 0.0 112.297 0.642 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.17 171.47 11.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.151 -179.729 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 4.3 m -101.46 2.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.198 -179.982 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.6 92.13 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.432 ' HB ' ' H ' ' A' ' 48' ' ' GLN . 12.3 m -102.21 -158.52 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.808 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.432 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 0.1 OUTLIER -68.03 -33.47 74.64 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.6 179.736 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.8 140.75 14.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.352 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -97.34 141.68 30.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 0.0 110.96 179.936 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.61 144.98 98.89 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.417 ' HA ' HD13 ' A' ' 77' ' ' LEU . 56.4 Cg_endo -70.58 -168.47 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.495 2.13 . . . . 0.0 112.402 -179.867 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.826 ' HB2' HD12 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -96.05 152.14 18.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.963 -179.751 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.571 HG21 ' O ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -168.36 -167.16 0.77 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.106 178.658 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 1.079 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -55.75 -34.5 65.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.51 -178.894 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 75.2 m -65.0 -51.54 61.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.646 179.569 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.658 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.1 -38.23 76.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.278 179.219 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.079 HD12 ' HA ' ' A' ' 55' ' ' ALA . 13.2 mt -63.03 -44.64 95.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.575 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.0 -15.99 38.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.96 179.736 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 t -72.76 -5.95 41.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 179.562 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.57 ' HB1' ' HB2' ' A' ' 64' ' ' GLN . . . -132.94 61.1 54.22 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.088 179.891 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.574 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 36.1 Cg_exo -58.59 -52.45 5.39 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.567 2.178 . . . . 0.0 113.575 -178.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.574 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 68.7 Cg_endo -89.91 -14.17 2.41 Favored 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.254 1.97 . . . . 0.0 112.951 -178.758 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.57 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 7.3 mm100 -86.07 -81.05 0.22 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.176 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.653 ' HB3' ' HB3' ' A' ' 68' ' ' GLN . 2.7 mm-40 -103.6 -94.43 0.32 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.107 -179.502 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.464 ' H ' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER 69.03 -17.32 0.21 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.946 0.403 . . . . 0.0 111.146 -178.918 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.666 ' CA ' HD21 ' A' ' 70' ' ' LEU . 1.8 mttt -136.62 11.16 3.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.291 178.915 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.653 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.8 tt0 -120.39 -56.55 1.97 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.681 -179.193 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.466 ' HB3' ' HB2' ' A' ' 73' ' ' ARG . 42.8 mtm -60.82 -7.92 2.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -177.572 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.666 HD21 ' CA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -64.73 -48.76 73.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.124 0.488 . . . . 0.0 110.204 -179.124 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.121 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -117.85 14.39 12.76 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.732 178.488 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -128.01 1.58 5.92 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.691 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.53 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 1.6 tpt180 -126.38 -34.6 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.244 -0.183 . . . . 0.0 110.897 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.758 ' HB3' HD11 ' A' ' 78' ' ' ILE . 3.0 mm? -59.14 -35.25 73.17 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 178.807 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.504 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 7.0 t80 -35.19 -61.68 0.48 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -174.533 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 33.8 Cg_endo -63.87 -16.86 57.27 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.057 1.838 . . . . 0.0 112.528 -178.972 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.826 HD12 ' HB2' ' A' ' 53' ' ' LEU . 52.4 mt -98.53 -23.95 15.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.799 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.758 HD11 ' HB3' ' A' ' 74' ' ' LEU . 1.6 mm -69.18 -35.78 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-O 120.97 0.414 . . . . 0.0 110.214 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.78 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 10.1 mt-30 -53.29 -17.32 1.71 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.26 -38.83 20.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.832 178.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -70.2 -44.85 67.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.126 0.489 . . . . 0.0 110.436 179.549 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.77 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -115.75 155.03 48.09 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.227 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.23 75.56 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.47 2.113 . . . . 0.0 111.994 179.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.78 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 30.3 p 47.17 45.85 16.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.213 -179.318 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 2.4 mp -103.39 9.09 38.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.073 -179.636 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.609 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -71.39 20.95 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.973 -179.219 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -48.64 -27.35 6.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 178.805 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 92' ' ' MET . 5.0 ttpt -171.9 40.41 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.154 178.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.778 HG21 HG13 ' A' ' 115' ' ' VAL . 47.8 mt -79.84 -83.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.649 178.684 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.121 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -54.5 -35.9 63.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.418 179.01 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.02 -30.2 60.19 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.219 -1.153 . . . . 0.0 110.219 176.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.586 ' HE1' ' O ' ' A' ' 118' ' ' ALA . 3.2 ttp -75.14 -36.11 61.61 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.031 -0.585 . . . . 0.0 109.882 176.451 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.669 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.6 mm? -59.9 -3.7 0.59 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.582 -177.656 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 101' ' ' LEU . 4.0 mp -109.2 26.16 10.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 175.669 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -170.86 3.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.34 -178.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.82 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.4 -150.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 121.483 0.659 . . . . 0.0 111.619 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 3.6 t70 -59.58 -2.76 0.38 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.108 177.356 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.634 ' H ' HG12 ' A' ' 96' ' ' ILE . 3.2 m120 77.99 -31.56 0.16 Allowed 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.208 -179.651 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.98 78.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.297 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.82 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.5 mt-10 -68.18 -43.91 77.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.367 177.388 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.731 HD23 HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -54.76 -21.83 12.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.804 0.335 . . . . 0.0 110.711 177.316 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.731 HD12 HD23 ' A' ' 101' ' ' LEU . 2.5 mp -92.92 -45.12 8.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.735 -179.197 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.1 OUTLIER -70.24 -30.25 67.27 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.708 -177.839 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.76 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 0.5 OUTLIER -65.19 -34.51 78.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.632 0.253 . . . . 0.0 110.78 179.846 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.747 HD23 HD13 ' A' ' 58' ' ' LEU . 5.7 mt -87.13 -12.14 47.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.167 0.508 . . . . 0.0 110.052 178.266 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 21.5 mm-40 -105.69 -4.72 20.67 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.083 -176.16 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.909 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.2 t -149.03 133.14 8.76 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.555 -179.415 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.571 ' O ' HG21 ' A' ' 54' ' ' THR . 74.4 Cg_endo -74.55 8.93 2.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.586 2.191 . . . . 0.0 112.358 179.723 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -133.89 -20.51 1.97 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.11 -179.882 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.909 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.2 OUTLIER -64.55 -53.31 49.98 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.208 0.528 . . . . 0.0 109.784 177.73 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.731 ' HG ' ' HE2' ' A' ' 104' ' ' MET . 10.0 tt -47.64 -35.36 9.25 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.175 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -86.63 -52.1 5.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.1 m -52.7 -50.13 63.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.663 -178.019 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.76 ' NZ ' ' HB3' ' A' ' 104' ' ' MET . 0.4 OUTLIER -80.4 -25.65 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.946 -178.533 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.778 HG13 HG21 ' A' ' 89' ' ' ILE . 1.1 t -59.9 -51.34 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.594 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.23 -34.42 70.42 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.434 177.467 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -77.18 -27.34 53.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.719 178.331 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.586 ' O ' ' HE1' ' A' ' 92' ' ' MET . . . -71.98 -27.74 62.96 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.224 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.77 HG11 ' ND1' ' A' ' 82' ' ' HIS . 16.4 t -58.2 -51.35 72.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.752 176.01 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.53 -28.53 31.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.797 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.52 -31.03 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.99 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.473 HD22 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -69.57 -41.75 75.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.9 179.094 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.459 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 82.4 mm-40 -72.49 -24.43 61.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.224 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.35 -6.83 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.189 179.427 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.749 ' HA ' ' HB3' ' A' ' 128' ' ' LYS . 3.9 t60 -113.45 -29.88 7.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.202 -179.481 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -58.72 -75.84 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -93.23 53.53 1.95 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.848 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.749 ' HB3' ' HA ' ' A' ' 125' ' ' HIS . 19.1 pttm -64.95 112.78 3.46 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.043 -175.225 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -86.94 11.75 12.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.215 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -81.41 19.16 1.02 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.381 -179.088 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -82.02 16.52 1.88 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 179.771 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.51 163.24 23.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.22 96.13 8.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.902 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -73.0 122.32 21.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.046 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.77 144.13 11.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.968 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -83.81 77.11 9.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.048 -179.834 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.52 162.93 13.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.9 -26.15 64.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.301 -179.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 4.6 t -103.7 142.62 34.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.036 -179.843 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -107.05 -147.04 13.58 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.47 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 3.5 m -98.89 129.95 28.66 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.562 0.22 . . . . 0.0 111.031 179.839 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -80.61 42.31 1.31 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.586 2.191 . . . . 0.0 112.532 -179.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.98 13.78 33.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.83 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.141 -179.896 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -80.57 47.68 2.64 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 -179.66 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.8 mt -84.62 -65.87 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.982 179.92 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.78 -36.22 5.36 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.588 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 m -91.22 84.29 5.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.857 0.36 . . . . 0.0 110.947 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.21 100.43 12.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -98.07 69.98 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.103 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 57.71 -168.28 0.12 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.166 -179.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -129.0 34.85 4.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.135 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.01 132.86 18.37 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.887 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.19 139.38 38.59 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.475 2.117 . . . . 0.0 112.209 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.54 -17.0 56.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.04 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.0 t -102.98 87.01 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.16 136.45 36.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.944 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -103.18 146.4 28.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.991 179.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 m -104.97 137.26 19.16 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.118 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.58 -3.4 13.4 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.512 2.141 . . . . 0.0 112.316 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -75.58 149.93 38.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.864 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -74.97 167.92 20.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.901 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -102.65 118.92 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -69.42 147.11 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.14 95.23 3.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.009 179.989 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.99 105.26 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.082 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -93.49 89.21 1.29 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.618 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.464 HG23 ' H ' ' A' ' 26' ' ' ARG . 0.2 OUTLIER -104.66 -57.45 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.335 . . . . 0.0 111.012 179.641 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.464 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.8 OUTLIER -98.5 177.04 5.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.867 179.835 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.504 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 3.6 m120 -88.35 -51.73 0.39 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.368 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 27' ' ' ASN . 16.7 Cg_exo -67.88 83.4 0.43 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.381 2.054 . . . . 0.0 112.066 179.984 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -90.37 -45.2 9.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.946 -179.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.02 174.3 9.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.936 179.935 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -133.01 62.33 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.901 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.28 134.57 34.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.915 179.912 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -94.1 -172.71 2.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.89 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.75 122.97 24.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.872 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.634 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 4.9 mm-40 -100.69 -52.04 0.18 Allowed Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.385 -179.971 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.634 ' HD3' ' HB2' ' A' ' 35' ' ' GLN . 29.7 Cg_exo -61.72 125.23 16.17 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.182 1.922 . . . . 0.0 112.164 -179.923 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -88.2 153.32 21.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.4 m -89.62 -32.25 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.274 -179.608 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.14 111.01 22.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.4 mtt -91.15 -26.01 19.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.746 179.596 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 58.85 177.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.346 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.458 ' H ' ' CD ' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -121.12 -53.95 0.04 OUTLIER Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.185 179.736 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.458 ' CD ' ' H ' ' A' ' 42' ' ' GLN . 23.1 Cg_exo -64.92 93.2 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.176 1.917 . . . . 0.0 112.046 179.748 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.59 168.05 6.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.107 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.27 100.59 10.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.984 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -95.39 146.43 24.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.979 -179.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 24.1 m -106.53 171.35 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.087 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -90.97 42.96 1.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.792 179.9 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.99 36.18 3.32 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.499 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.55 61.77 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.53 120.63 71.17 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' O ' ' SD ' ' A' ' 57' ' ' MET . 61.5 Cg_endo -73.13 -167.02 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.445 2.097 . . . . 0.0 112.377 -179.668 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.784 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -90.37 146.79 23.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.59 -179.94 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.81 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -166.86 -176.35 3.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.144 0.497 . . . . 0.0 111.999 179.553 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.08 -56.91 12.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.393 -0.822 . . . . 0.0 112.686 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.2 m -47.37 -34.36 6.89 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.105 0.478 . . . . 0.0 110.97 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.674 ' SD ' ' HA ' ' A' ' 53' ' ' LEU . 4.3 mtt -75.35 -41.54 56.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.447 179.141 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -55.98 -38.09 69.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.822 176.859 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.22 -23.66 62.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.428 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -68.15 -7.39 29.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.29 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.746 ' HB1' ' HB3' ' A' ' 64' ' ' GLN . . . -133.4 63.57 65.64 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.259 -179.742 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.639 ' HB2' ' HD3' ' A' ' 63' ' ' PRO . 52.3 Cg_exo -55.0 -53.13 6.44 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.514 2.143 . . . . 0.0 113.028 -179.08 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 69.5 Cg_endo -98.51 22.95 0.26 Allowed 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.539 2.16 . . . . 0.0 112.757 -179.156 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.746 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -128.4 -94.89 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.711 -178.852 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.69 ' HB2' ' HG2' ' A' ' 69' ' ' MET . 0.0 OUTLIER -107.12 40.14 1.73 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -177.813 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.567 ' HG3' ' HA ' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -70.92 -23.06 62.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.903 0.382 . . . . 0.0 110.86 179.369 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.611 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.4 28.99 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.966 -179.822 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.429 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -134.08 -52.02 0.84 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.194 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.69 ' HG2' ' HB2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -78.48 15.89 0.92 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -177.175 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -89.43 -31.72 17.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.115 0.483 . . . . 0.0 110.591 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.024 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -132.36 10.39 5.31 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.552 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -127.92 -6.17 5.59 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.583 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -126.54 -16.51 5.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.935 0.397 . . . . 0.0 110.565 179.354 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.784 ' HG ' ' HB3' ' A' ' 53' ' ' LEU . 0.2 OUTLIER -77.72 -16.75 58.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.059 178.964 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.725 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 13.8 t80 -49.34 -53.88 35.48 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.924 -177.543 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 23.1 Cg_exo -65.73 -6.45 14.0 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.149 1.9 . . . . 0.0 112.494 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.608 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.8 mm? -98.78 -38.68 8.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.635 -179.274 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.783 ' HB ' ' HB2' ' A' ' 86' ' ' ALA . 4.8 mm -60.0 -40.47 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.883 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.904 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 31.0 mt-30 -47.66 -21.45 0.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.796 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.11 -44.03 17.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.848 178.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -66.78 -43.14 84.75 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.302 0.572 . . . . 0.0 110.225 179.187 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.871 ' CE1' HG21 ' A' ' 119' ' ' VAL . 4.7 m170 -121.52 143.99 39.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.456 -177.729 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.53 80.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.563 2.175 . . . . 0.0 112.254 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.904 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 61.9 p 43.32 32.72 0.51 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.196 -179.115 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -88.34 6.93 34.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.09 -179.367 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.783 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . . . -71.59 20.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.882 -179.422 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 85' ' ' LEU . . . -54.26 -22.62 22.88 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.834 -179.933 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.0 OUTLIER -165.46 28.76 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.0 111.216 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.866 HG21 HG13 ' A' ' 115' ' ' VAL . 60.8 mt -80.42 -88.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.386 -0.525 . . . . 0.0 110.817 179.019 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.024 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -51.02 -41.5 59.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.279 -179.943 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -55.67 -31.13 57.48 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.068 -1.063 . . . . 0.0 111.055 178.497 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.63 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.43 -23.29 32.37 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 178.685 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.628 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.4 mm? -61.63 -7.53 3.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.631 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.666 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.6 mp -106.66 26.26 10.2 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 7.7 pt-20 -167.08 1.87 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.33 -178.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.948 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -62.92 -151.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 121.334 0.587 . . . . 0.0 111.697 -179.702 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 0.8 OUTLIER -59.04 -3.56 0.37 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.998 177.949 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 97' ' ' ASP . 34.3 m-80 79.19 -28.65 0.15 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.524 179.536 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -31.22 60.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.09 0.471 . . . . 0.0 109.877 178.201 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.948 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.6 mt-10 -75.42 -23.32 56.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.937 177.863 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -75.1 -25.62 58.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.862 177.031 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mp -87.15 -49.38 7.33 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.984 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.49 -46.97 87.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.709 -179.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.924 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -53.2 -36.51 61.05 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -178.169 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' HD23 ' A' ' 58' ' ' LEU . 6.9 mt -86.64 -5.5 59.11 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.342 0.592 . . . . 0.0 110.071 179.1 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -110.44 -8.09 14.71 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.001 -175.026 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.476 ' HB3' ' OG ' ' A' ' 110' ' ' SER . 0.4 OUTLIER -146.25 142.0 17.09 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.061 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.507 ' O ' HG21 ' A' ' 54' ' ' THR . 7.5 Cg_exo -73.2 -0.57 9.34 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 179.437 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -124.43 -19.38 5.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.568 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' A' ' 107' ' ' SER . 4.4 p -63.74 -50.53 68.71 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.233 0.54 . . . . 0.0 109.79 178.169 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.924 HD22 ' HB2' ' A' ' 104' ' ' MET . 0.2 OUTLIER -46.49 -29.24 1.67 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.118 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.59 -63.42 1.23 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.985 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 43.5 m -49.31 -30.21 7.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.958 179.15 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 18.0 mmtm -80.84 -41.22 23.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.844 178.093 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.866 HG13 HG21 ' A' ' 89' ' ' ILE . 2.0 t -66.43 -62.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.124 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t0 -48.67 -36.13 15.37 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.644 0.259 . . . . 0.0 111.258 178.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 113' ' ' SER . 7.4 mt-10 -74.05 -41.14 62.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.818 0.342 . . . . 0.0 110.514 179.114 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -62.44 -21.77 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.691 178.057 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.871 HG21 ' CE1' ' A' ' 82' ' ' HIS . 59.1 t -66.79 -46.43 85.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.866 177.412 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.16 -26.57 66.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.506 176.652 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' HB2' ' A' ' 125' ' ' HIS . 11.2 t -85.32 -32.08 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.579 179.057 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.503 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -71.79 -35.77 70.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.825 179.004 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -71.97 -28.52 63.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.114 178.33 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -88.88 -6.32 57.39 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.235 179.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.614 ' HA ' ' HB2' ' A' ' 130' ' ' ALA . 0.2 OUTLIER -122.05 8.35 9.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.561 -178.808 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 20.1 mt-30 -75.43 -105.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.611 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.42 26.56 3.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.85 0.357 . . . . 0.0 110.998 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.17 -148.7 0.3 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.055 -179.196 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.04 49.2 1.77 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.074 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.614 ' HB2' ' HA ' ' A' ' 125' ' ' HIS . . . -88.71 19.29 4.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.62 -1.15 41.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.739 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.83 108.59 9.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.905 179.896 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 9.8 mttp -66.64 -27.22 67.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.006 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.38 157.67 35.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 -179.988 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.2 m -95.84 173.05 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.151 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -66.36 157.61 31.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.941 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.46 132.8 42.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.986 -179.973 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -77.84 92.26 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.068 179.897 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 72.8 p -102.53 -12.34 17.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.917 -179.942 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -87.92 -66.93 1.31 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.545 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 5.2 t -100.86 129.96 26.27 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.476 0.179 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -82.22 165.82 71.73 Favored 'Cis proline' 0 C--N 1.349 0.557 0 C-N-CA 123.562 -1.432 . . . . 0.0 112.483 0.228 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 77.7 p -85.83 -172.32 4.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.076 179.899 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.526 -0.23 . . . . 0.0 112.526 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.07 -32.12 64.6 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.564 2.176 . . . . 0.0 112.137 179.873 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.6 mt -98.59 177.09 5.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.962 179.957 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.77 -62.16 0.68 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.514 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -103.52 154.21 19.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.342 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -145.8 47.04 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.004 -179.994 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.7 -3.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.17 -179.872 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.404 ' H ' ' H ' ' A' ' 9' ' ' ALA . . . -159.53 -13.95 0.06 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.995 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.404 ' H ' ' H ' ' A' ' 8' ' ' ALA . . . 59.11 -91.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.205 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 5.1 m 64.91 124.04 0.02 OUTLIER Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.251 179.774 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' A' ' 10' ' ' THR . 94.1 Cg_endo -79.65 170.88 65.87 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.545 -1.44 . . . . 0.0 112.419 -0.036 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.18 -46.24 11.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.001 179.847 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.4 m -81.07 174.72 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.097 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 14' ' ' ARG . 3.6 mtp180 -98.82 84.6 3.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -111.85 21.29 16.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.583 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 35.1 m -92.24 -29.5 0.31 Allowed Pre-proline 0 CA--C 1.54 0.57 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 16' ' ' VAL . 25.4 Cg_exo -63.6 176.89 1.97 Allowed 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.747 1.631 . . . . 0.0 112.12 -179.834 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -75.81 -168.78 0.94 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.969 -179.955 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -63.64 106.04 0.9 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 109.91 22.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.026 179.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -77.43 82.67 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.806 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -88.31 130.26 35.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.161 -179.655 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.43 120.11 15.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.009 179.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.26 52.29 1.08 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.569 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.0 p -86.45 -31.66 6.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 179.891 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 -88.87 108.07 19.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.909 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -90.42 144.77 31.32 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.86 23.02 0.58 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.529 2.152 . . . . 0.0 112.645 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -72.9 102.09 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.864 179.766 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.445 ' NE2' ' HB2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -92.66 -79.74 0.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.07 -179.681 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 54.66 49.17 18.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 -179.83 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.445 ' HB2' ' NE2' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -78.28 117.71 19.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.017 -179.737 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.21 72.85 7.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.668 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.71 76.44 5.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.16 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.525 ' N ' ' HD2' ' A' ' 36' ' ' PRO . 1.1 tm0? -83.01 -51.05 0.69 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 35' ' ' GLN . 54.3 Cg_endo -69.0 -17.89 40.84 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.199 1.933 . . . . 0.0 112.169 179.766 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.95 109.33 10.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -97.62 90.81 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 179.921 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -109.17 -56.92 2.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.987 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.33 168.19 11.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.981 -179.896 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -85.79 154.0 21.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.967 179.987 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -117.96 91.09 38.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.51 126.88 23.78 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.64 2.227 . . . . 0.0 112.302 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.72 90.36 8.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.045 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -101.5 92.84 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.115 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -82.27 105.36 13.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 -179.895 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 6.3 p -109.95 19.31 6.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.114 0.483 . . . . 0.0 110.893 -179.882 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.35 -34.51 76.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.742 179.579 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.91 79.58 1.85 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.322 179.617 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.71 104.12 14.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.807 0.337 . . . . 0.0 111.017 -179.69 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.624 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 2.2 mt-10 -75.34 -49.16 4.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.448 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.624 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 18.4 Cg_endo -58.07 144.99 93.92 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.215 1.944 . . . . 0.0 112.241 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.825 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -83.07 148.11 27.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.95 -179.828 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.904 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -163.62 -171.95 2.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.489 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 104' ' ' MET . . . -53.73 -36.88 62.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.192 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.95 -46.01 92.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.064 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.825 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.66 -43.22 89.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.056 178.325 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.532 HD23 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -57.77 -48.23 80.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.572 178.973 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.37 -3.21 19.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.367 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.466 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 8.4 t -87.23 -6.77 58.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.074 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.613 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.7 53.98 11.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.675 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.613 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 88.5 Cg_endo -103.21 114.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.018 2.479 . . . . 0.0 113.241 -178.53 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 91.4 Cg_endo -101.11 132.11 1.71 Allowed 'Cis proline' 0 N--CA 1.456 -0.706 0 C-N-CA 124.574 -1.011 . . . . 0.0 112.388 -0.205 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.519 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -173.23 -86.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.738 0.304 . . . . 0.0 111.211 179.792 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.504 ' HB3' ' HG2' ' A' ' 69' ' ' MET . 4.4 mm-40 -94.19 8.13 42.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.999 -179.249 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -48.32 66.08 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.648 179.406 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.651 ' HA ' HD21 ' A' ' 70' ' ' LEU . 5.4 ptpt -116.18 40.65 2.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.888 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' A' ' 65' ' ' GLU . 10.0 mt-30 -139.23 -54.54 0.58 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.614 ' SD ' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -81.08 3.07 24.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.849 -178.889 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.816 HD13 HD21 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -69.97 -39.33 76.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 0.0 111.085 179.765 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.082 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -135.34 24.96 3.34 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.236 -0.983 . . . . 0.0 112.87 -179.504 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -138.09 -5.42 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.582 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.0 OUTLIER -127.28 -20.85 4.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.873 -179.825 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.744 ' HA ' HD23 ' A' ' 77' ' ' LEU . 0.2 OUTLIER -74.83 -13.09 60.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.692 -178.748 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.719 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 8.4 t80 -48.32 -56.71 13.06 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.703 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.719 ' HD3' ' HB3' ' A' ' 75' ' ' PHE . 24.5 Cg_exo -63.29 -11.7 26.77 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.042 1.828 . . . . 0.0 112.046 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 ' HA ' ' A' ' 74' ' ' LEU . 1.1 mm? -94.79 -28.35 15.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.462 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.763 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 9.9 mm -67.78 -39.64 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.013 -179.608 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.881 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 12.6 mt-30 -50.47 -20.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 110.125 178.682 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 77' ' ' LEU . . . -80.75 -40.87 24.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.449 179.668 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.763 ' SD ' ' HA ' ' A' ' 78' ' ' ILE . 0.0 OUTLIER -71.44 -50.75 28.7 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.184 0.516 . . . . 0.0 110.52 -179.62 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.784 ' ND1' HG11 ' A' ' 119' ' ' VAL . 2.0 m-70 -111.49 151.61 43.39 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.491 -179.673 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.612 ' HG2' HD23 ' A' ' 85' ' ' LEU . 18.8 Cg_endo -59.53 81.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.387 2.058 . . . . 0.0 111.798 179.555 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.881 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 7.0 t 42.13 31.0 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.532 -178.776 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.654 ' HB2' ' HB3' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -80.45 2.22 26.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.598 ' HA ' HD12 ' A' ' 89' ' ' ILE . . . -66.01 -144.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.971 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.72 -15.62 50.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.69 -179.114 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.833 ' HE2' ' HB2' ' A' ' 92' ' ' MET . 1.1 tptt -156.46 -22.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.953 HG21 HG13 ' A' ' 115' ' ' VAL . 68.4 mt -49.25 -86.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -177.491 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.082 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.6 OUTLIER -52.97 -41.83 64.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.276 -178.599 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 71' ' ' GLY . . . -54.27 -31.45 50.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.217 178.463 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.833 ' HB2' ' HE2' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -83.79 -25.06 30.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.885 0.374 . . . . 0.0 110.323 179.185 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.616 HD12 ' HE3' ' A' ' 104' ' ' MET . 4.1 mm? -59.08 -10.86 2.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.417 178.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.816 HD21 HD13 ' A' ' 70' ' ' LEU . 3.8 mp -101.89 25.97 8.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.728 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 92' ' ' MET . 5.5 pt-20 -169.1 1.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.154 -177.614 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.981 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.42 -148.7 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.41 0.624 . . . . 0.0 111.408 -179.417 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.616 ' N ' HG12 ' A' ' 96' ' ' ILE . 10.2 t70 -54.33 -9.42 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.824 176.081 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.719 ' H ' HG12 ' A' ' 96' ' ' ILE . 25.5 m120 79.88 -23.1 0.25 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.138 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -32.74 58.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.408 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB2' HG13 ' A' ' 96' ' ' ILE . 1.7 mp0 -69.65 -34.64 74.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.049 177.545 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.668 HD21 HD22 ' A' ' 70' ' ' LEU . 2.3 tm? -65.9 -28.73 69.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.274 178.741 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.15 -49.85 9.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.911 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.509 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 1.5 t-80 -58.79 -48.44 81.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.958 -178.888 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.801 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.9 OUTLIER -52.29 -35.5 50.56 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.157 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 101' ' ' LEU . 17.5 mt -84.8 -8.78 58.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 0.0 110.791 -179.404 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 103' ' ' HIS . 0.0 OUTLIER -108.06 -7.33 16.14 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.615 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.467 ' HB3' ' H ' ' A' ' 110' ' ' SER . 0.5 OUTLIER -143.13 140.15 17.53 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 120.506 -0.477 . . . . 0.0 112.042 -179.169 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.563 ' O ' HG21 ' A' ' 54' ' ' THR . 60.1 Cg_endo -72.18 3.8 3.77 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.645 2.23 . . . . 0.0 111.991 179.07 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -128.72 -19.01 3.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.467 ' H ' ' HB3' ' A' ' 107' ' ' SER . 4.9 p -64.22 -49.86 70.29 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.356 0.598 . . . . 0.0 109.675 177.447 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.904 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -46.95 -26.78 1.07 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.783 178.05 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -95.94 -65.69 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.78 179.311 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 5.0 m -46.12 -30.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.296 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.786 ' HD2' ' HG3' ' A' ' 100' ' ' GLU . 69.4 mmtt -80.44 -42.44 22.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.697 177.819 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.953 HG13 HG21 ' A' ' 89' ' ' ILE . 2.2 t -66.06 -60.37 2.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.874 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.404 ' N ' HG12 ' A' ' 115' ' ' VAL . 5.3 t70 -48.0 -38.9 18.14 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.31 178.679 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 113' ' ' SER . 1.9 mt-10 -76.87 -33.27 57.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.271 179.466 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.751 ' HB1' ' SD ' ' A' ' 92' ' ' MET . . . -67.55 -26.79 66.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.882 177.958 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.784 HG11 ' ND1' ' A' ' 82' ' ' HIS . 20.0 t -61.52 -51.14 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.05 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.58 32.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.779 177.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 14.3 t -85.52 -31.35 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.945 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.701 HD13 ' HB3' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -73.53 -41.31 63.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.026 179.363 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.43 ' N ' ' HG ' ' A' ' 122' ' ' LEU . 2.2 mm-40 -61.69 -37.96 86.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 178.822 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 126' ' ' GLN . . . -65.82 -79.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.352 177.072 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 128' ' ' LYS . 0.3 OUTLIER -31.49 -37.53 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.715 0.634 . . . . 0.0 112.223 -178.61 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 122' ' ' LEU . 22.0 mt-30 -62.44 -83.38 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 179.256 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -96.56 31.35 2.3 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.811 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.654 ' HG3' ' N ' ' A' ' 130' ' ' ALA . 0.0 OUTLIER -96.22 -160.33 0.79 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.243 0.544 . . . . 0.0 111.18 179.034 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.93 31.55 0.78 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.325 176.594 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.654 ' N ' ' HG3' ' A' ' 128' ' ' LYS . . . -69.24 5.2 1.33 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.876 -177.613 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.24 13.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.489 -179.432 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -68.46 -20.1 64.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.1 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.37 7.06 15.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.021 -179.776 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -94.45 -39.23 10.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.136 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 135' ' ' VAL . 12.3 m -84.53 -5.09 9.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.207 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -85.73 123.97 31.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.916 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 48.1 p -86.59 115.4 24.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.021 -179.889 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -81.82 76.56 8.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.95 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 12.3 t -97.47 20.84 11.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.789 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -78.48 111.57 3.28 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.566 179.975 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 3.0 t -96.28 129.24 34.09 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.511 0.196 . . . . 0.0 110.984 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -55.93 118.7 5.52 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.525 2.15 . . . . 0.0 112.317 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 3.6 p -87.72 50.08 1.93 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.1 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.178 179.938 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.143 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.96 168.58 22.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.517 2.145 . . . . 0.0 112.404 -179.851 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.69 138.65 35.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.925 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.15 4.82 45.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.507 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.07 -67.67 0.79 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 110.924 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.47 -166.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.163 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.58 -80.08 0.44 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.171 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -151.55 118.08 5.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.47 27.39 1.72 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.062 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.686 ' N ' ' HA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -78.99 -50.6 1.39 Allowed Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.585 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.686 ' HA ' ' N ' ' A' ' 10' ' ' THR . 68.8 Cg_endo -91.5 -5.78 46.07 Favored 'Cis proline' 0 C--N 1.355 0.917 0 C-N-CA 124.603 -0.999 . . . . 0.0 112.648 0.479 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.564 ' N ' ' HB ' ' A' ' 10' ' ' THR . . . -70.22 94.93 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.034 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.9 t -92.31 92.79 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.056 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -96.36 -60.46 1.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.894 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.652 HG22 ' HD3' ' A' ' 63' ' ' PRO . 5.9 p -103.49 92.34 4.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.837 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.575 HG22 ' H ' ' A' ' 18' ' ' GLN . 4.2 p -102.38 126.42 33.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.972 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 16' ' ' VAL . 28.1 Cg_exo -62.25 -26.2 77.28 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.625 2.217 . . . . 0.0 112.222 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.575 ' H ' HG22 ' A' ' 16' ' ' VAL . 53.8 mm-40 -82.91 163.42 21.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.93 -179.797 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -78.61 172.78 13.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.908 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 65.2 0.94 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.81 179.932 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -74.06 -18.05 60.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.57 -49.91 9.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.092 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.17 114.73 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.095 -179.844 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.633 ' HA3' ' HG2' ' A' ' 28' ' ' PRO . . . -104.08 91.01 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.388 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.656 ' HA ' ' HB2' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -107.32 4.86 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.808 0.337 . . . . 0.0 111.134 -179.665 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -98.51 -72.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.083 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.545 ' HB2' ' HD3' ' A' ' 28' ' ' PRO . 10.6 m-80 -90.82 -50.61 0.33 Allowed Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.536 -179.47 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.633 ' HG2' ' HA3' ' A' ' 24' ' ' GLY . 47.5 Cg_exo -57.24 -31.47 90.82 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.192 1.928 . . . . 0.0 112.499 -179.549 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.656 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 0.0 OUTLIER -78.34 -21.98 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.125 -179.664 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -99.41 178.12 4.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.866 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 -98.24 40.02 1.21 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.813 179.88 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.96 4.36 26.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.973 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 97.47 8.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.857 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.13 58.09 4.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.498 ' HB3' ' HD3' ' A' ' 36' ' ' PRO . 18.6 tt0 -81.23 -51.92 0.86 Allowed Pre-proline 0 CA--C 1.533 0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.389 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.766 ' HB2' HG22 ' A' ' 38' ' ' VAL . 93.7 Cg_endo -78.62 137.95 14.86 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.171 1.914 . . . . 0.0 112.32 -179.905 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -90.69 39.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.766 HG22 ' HB2' ' A' ' 36' ' ' PRO . 1.9 m -98.55 67.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.071 -179.959 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.37 89.67 7.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.919 -179.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 37.7 mtm -83.72 1.3 43.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 179.918 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 55.38 63.98 1.92 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.99 -179.762 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -136.34 92.22 15.78 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 -179.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.25 -168.89 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.591 2.194 . . . . 0.0 112.275 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.12 156.58 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.068 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.526 HG23 ' H ' ' A' ' 46' ' ' HIS . 0.0 OUTLIER -97.82 -79.2 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.935 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.526 ' H ' HG23 ' A' ' 45' ' ' VAL . 36.8 m80 -110.26 94.17 4.87 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.975 0.417 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.466 ' O ' ' HG3' ' A' ' 50' ' ' GLN . 9.8 p -88.88 31.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.202 0.525 . . . . 0.0 110.944 -179.684 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -68.01 -18.14 64.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.0 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.77 67.24 0.58 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.871 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 47' ' ' VAL . 89.6 mt-30 -93.04 100.82 13.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.739 0.304 . . . . 0.0 110.88 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 1.7 mm-40 -85.89 108.37 16.59 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.913 -179.916 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 6.3 Cg_exo -78.85 -177.07 3.63 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.872 2.381 . . . . 0.0 112.058 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.735 ' HA ' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -79.21 153.65 29.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.736 179.347 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.886 ' HA ' ' HG ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -168.11 -176.44 2.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.294 179.099 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.972 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -52.23 -25.06 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 111.269 -179.488 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.449 ' HB2' ' CE ' ' A' ' 57' ' ' MET . 40.6 m -74.23 -49.13 24.65 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.741 179.562 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.735 ' HG2' ' HA ' ' A' ' 53' ' ' LEU . 0.0 OUTLIER -58.11 -39.45 78.69 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.376 0.608 . . . . 0.0 109.997 178.776 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.972 HD12 ' HA ' ' A' ' 55' ' ' ALA . 8.3 mt -64.1 -45.04 90.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.418 179.102 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.79 -7.85 18.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.844 179.066 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.465 ' C ' ' HD3' ' A' ' 62' ' ' PRO . 23.4 t -84.05 -7.3 59.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.616 179.317 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.589 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -133.18 55.47 16.96 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.319 179.819 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.589 ' HD3' ' N ' ' A' ' 61' ' ' ALA . 62.7 Cg_endo -101.59 122.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.184 2.589 . . . . 0.0 112.986 -178.435 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.652 ' HD3' HG22 ' A' ' 15' ' ' THR . 88.8 Cg_endo -100.1 31.33 10.8 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 124.463 -1.057 . . . . 0.0 112.095 -0.606 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.529 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 4.0 tt0 -55.61 -89.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.586 -178.428 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.677 ' HB3' ' HB3' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -107.11 28.14 8.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.004 -179.29 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -44.0 69.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.051 0.453 . . . . 0.0 110.123 179.147 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.456 ' C ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -107.85 36.72 2.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.473 178.471 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.677 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.3 tp-100 -127.6 -52.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.666 ' HG3' ' HB2' ' A' ' 65' ' ' GLU . 14.4 mtm -76.03 -6.17 49.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.659 -179.378 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.82 HD13 HD11 ' A' ' 94' ' ' LEU . 0.1 OUTLIER -63.2 -32.45 73.85 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.172 -179.421 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 1.036 ' HA2' HG23 ' A' ' 90' ' ' THR . . . -148.74 27.48 1.31 Allowed Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.822 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' GLN . 3.3 mt-10 -142.29 0.39 1.33 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.891 0.377 . . . . 0.0 111.173 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 0.2 OUTLIER -136.12 -20.84 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.169 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.647 ' HG ' HD22 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -73.48 -22.7 60.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.353 178.283 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.538 ' HB3' ' HD3' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -39.82 -56.04 3.34 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.355 -177.906 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' O ' ' A' ' 73' ' ' ARG . 11.6 Cg_exo -73.1 -15.74 25.69 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.326 2.017 . . . . 0.0 112.784 -179.255 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.68 HD12 ' HB2' ' A' ' 53' ' ' LEU . 37.1 mt -91.23 -32.01 15.93 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.624 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 74' ' ' LEU . 2.5 mm -65.19 -37.13 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.089 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.768 ' HG2' ' HA ' ' A' ' 84' ' ' THR . 6.0 mt-30 -48.92 -16.16 0.12 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.495 177.14 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.429 ' N ' ' C ' ' A' ' 78' ' ' ILE . . . -84.27 -44.58 13.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.675 178.186 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.427 ' HG3' ' HA ' ' A' ' 78' ' ' ILE . 1.2 mtm -67.67 -27.81 67.16 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.563 0.697 . . . . 0.0 110.18 178.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.616 ' CD2' HD11 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -114.29 164.2 16.97 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.739 -177.257 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.498 ' HD2' ' CG ' ' A' ' 82' ' ' HIS . 74.0 Cg_endo -77.11 47.68 2.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.134 1.889 . . . . 0.0 111.368 177.021 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.768 ' HA ' ' HG2' ' A' ' 79' ' ' GLN . 1.4 m 66.45 51.05 1.2 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.796 -178.487 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HB3' ' CD2' ' A' ' 82' ' ' HIS . 0.4 OUTLIER -118.94 0.81 11.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.719 179.789 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.556 ' CB ' ' HB ' ' A' ' 78' ' ' ILE . . . -73.46 58.63 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.179 179.455 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -98.24 -0.7 58.3 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.885 ' HE3' ' HG3' ' A' ' 92' ' ' MET . 2.5 ttpt -156.74 -15.79 0.09 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.023 -0.588 . . . . 0.0 111.908 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.958 HG21 HG13 ' A' ' 115' ' ' VAL . 48.5 mt -51.18 -84.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -176.812 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 1.036 HG23 ' HA2' ' A' ' 71' ' ' GLY . 0.4 OUTLIER -51.46 -38.37 53.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.02 -177.851 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.95 -29.87 68.77 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.99 -1.1 . . . . 0.0 110.367 176.262 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.885 ' HG3' ' HE3' ' A' ' 88' ' ' LYS . 2.4 ttm -75.56 -37.75 59.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.042 176.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.577 ' HA ' HG23 ' A' ' 96' ' ' ILE . 4.6 mm? -55.61 -8.34 0.37 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.48 -178.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.82 HD11 HD13 ' A' ' 70' ' ' LEU . 4.9 mp -106.26 27.94 8.2 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.688 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.407 ' H ' ' H ' ' A' ' 96' ' ' ILE . 7.4 pt-20 -171.98 3.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.462 -178.252 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.934 HG13 ' HB2' ' A' ' 100' ' ' GLU . 0.2 OUTLIER -63.22 -151.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.318 0.58 . . . . 0.0 111.496 -179.86 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.509 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 4.8 t0 -59.53 -3.54 0.48 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.237 178.253 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.594 ' H ' HG12 ' A' ' 96' ' ' ILE . 27.4 m120 77.82 -27.23 0.17 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.425 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -77.75 -23.35 49.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 177.785 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.934 ' HB2' HG13 ' A' ' 96' ' ' ILE . 2.1 mt-10 -83.92 -25.87 29.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.676 177.512 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.4 OUTLIER -74.99 -24.75 58.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.393 0.615 . . . . 0.0 109.385 176.134 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -86.73 -48.6 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.074 -0.967 . . . . 0.0 111.158 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.446 ' HA ' ' HB2' ' A' ' 106' ' ' GLU . 0.3 OUTLIER -67.04 -37.28 83.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.194 -178.695 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.825 ' HB2' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -57.56 -36.82 72.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.136 -179.85 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.714 HD23 HD13 ' A' ' 58' ' ' LEU . 6.9 mt -87.11 -9.77 54.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.211 0.529 . . . . 0.0 110.047 178.445 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 103' ' ' HIS . 62.8 mm-40 -108.44 -1.98 19.4 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.28 -176.144 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.845 ' HB3' ' HB2' ' A' ' 110' ' ' SER . 1.1 t -150.32 135.95 10.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.764 -179.462 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.528 ' O ' HG21 ' A' ' 54' ' ' THR . 72.5 Cg_endo -74.04 3.98 4.63 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.566 2.177 . . . . 0.0 112.04 179.025 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 113' ' ' SER . 7.7 mt-10 -128.0 -11.41 5.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.607 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.845 ' HB2' ' HB3' ' A' ' 107' ' ' SER . 0.5 OUTLIER -78.83 -44.68 22.48 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.606 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.886 ' HG ' ' HA ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -47.28 -40.82 17.67 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.95 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -81.16 -64.39 1.2 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.28 179.38 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -48.01 -51.13 25.24 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.065 -178.702 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.814 ' HB3' ' HB3' ' A' ' 100' ' ' GLU . 30.9 mmtt -61.01 -30.18 70.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.845 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.958 HG13 HG21 ' A' ' 89' ' ' ILE . 1.4 t -72.83 -55.0 14.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.62 ' O ' ' HB ' ' A' ' 119' ' ' VAL . 0.5 OUTLIER -56.9 -28.65 62.2 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.227 0.537 . . . . 0.0 109.927 177.314 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -80.02 -33.93 38.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.383 177.223 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.736 ' HB1' ' HE3' ' A' ' 92' ' ' MET . . . -68.67 -17.87 64.17 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.514 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.62 ' HB ' ' O ' ' A' ' 116' ' ' ASP . 37.1 t -66.77 -52.79 41.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.412 175.864 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.06 -27.49 61.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.968 177.389 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 15.2 t -85.94 -31.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.691 179.123 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -74.14 -29.35 61.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.348 -179.733 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -83.2 -23.59 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.786 177.28 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -86.94 -6.14 58.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.054 179.32 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -115.61 -36.13 4.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.82 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.82 -81.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 177.721 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.29 54.93 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 174.165 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 128.55 36.29 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.043 -175.113 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -87.18 -1.14 57.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.333 177.347 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.81 -7.28 49.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.72 -8.73 57.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.6 130.66 43.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.92 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 29.5 mmtt -69.18 -18.47 63.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.841 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.07 112.41 23.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.995 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 4.6 m -88.67 48.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -90.14 16.41 8.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.869 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.6 -65.69 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -86.44 -44.45 12.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.15 -179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.92 93.54 8.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.904 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -96.74 158.79 21.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.541 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.631 ' HB ' ' HD3' ' A' ' 142' ' ' PRO . 12.0 t -97.7 -51.49 0.22 Allowed Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.772 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.631 ' HD3' ' HB ' ' A' ' 141' ' ' VAL . 47.4 Cg_exo -56.45 -52.41 7.13 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.15 1.9 . . . . 0.0 112.323 -179.866 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 67.7 p -105.61 126.04 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.014 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.008 179.99 . . . . . . . . 0 0 . 1 stop_ save_